Device for measuring charge density distribution in charged particle beams
International Nuclear Information System (INIS)
A device to measure charge density distribution in charged particle beams has been described. The device contains a set of hollow interinsulated current-receiving electrodes, recording system, and cooling system. The invention is aimed at the increase of admissible capacity of the beams measured at the expense of cooling efficiency increase. The aim is achieved by the fact, that in the device a dynamic evaporating-condensational cooling of electrodes is realized by means of cooling agent supply in perpendicular to their planes through the tubes introduced inside special cups. Spreading in radial direction over electrode surface the cooling agent gradually and intensively washes the side surface of the cup, after that, it enters the cooling cavity in the form of vapour-liquid mixture. In the cavity the cooling agent, supplied using dispensina and receiving collectors in which vapoUr is condensed, circulates. In the device suggested the surface of electrode cooling is decreased significantly at the expense of side surface of the cups which receives the electrode heat
Leherte, Laurence; Vercauteren, Daniel P
2011-10-01
To generate reduced point charge models of proteins, we developed an original approach to hierarchically locate extrema in charge density distribution functions built from the Poisson equation applied to smoothed molecular electrostatic potential (MEP) functions. A charge fitting program was used to assign charge values to the so-obtained reduced representations. In continuation to a previous work, the Amber99 force field was selected. To easily generate reduced point charge models for protein structures, a library of amino acid templates was designed. Applications to four small peptides, a set of 53 protein structures, and four KcsA ion channel models, are presented. Electrostatic potential and solvation free energy values generated by the reduced models are compared with the corresponding values obtained using the original set of atomic charges. Results are in closer agreement with the original all-atom electrostatic properties than those obtained with a previous reduced model that was directly built from the smoothed MEP functions [Leherte and Vercauteren in J Chem Theory Comput 5:3279-3298, 2009]. PMID:21915750
International Nuclear Information System (INIS)
The charge form factors of elastic electron scattering for isotones with N=20 and N=28 are calculated using the phase-shift analysis method, with corresponding charge density distributions from relativistic mean-field theory. The results show that there are sharp variations at the inner parts of charge distributions with the proton number decreasing. The corresponding charge form factors are divided into two groups because of the unique properties of the s-states wave functions, though the proton numbers change uniformly in two isotonic chains. Meanwhile, the shift regularities of the minima are also discussed, and we give a clear relation between the minima of the charge form factors and the corresponding charge radii. This relation is caused by the diffraction effect of the electron. Under this conclusion, we calculate the charge density distributions and the charge form factors of the A=44 nuclei chain. The results are also useful for studying the central depression in light exotic nuclei. (authors)
The effect of polymer charge density and charge distribution on the formation of multilayers
Voigt, U; Tauer, K; Hahn, M; Jäger, W; Klitzing, K V
2003-01-01
Polyelectrolyte multilayers which are built up by alternating adsorption of polyanions and polycations from aqueous solutions at a solid interface are investigated by reflectometry and ellipsometry. Below a degree of charge of about 70% the adsorption stops after a certain number of dipping cycles and no multilayer formation occurs. This indicates an electrostatically driven adsorption process. Below a charge density of 70% an adsorption can take place if the charged segments are combined as a block of the polymer.
Fractal dimension of the topological charge density distribution in SU(2) lattice gluodynamics
Energy Technology Data Exchange (ETDEWEB)
Buividovich, P.V. [Joint Institute for Nuclear Research, Dubna (Russian Federation); Institute for Theoretical and Experimental Physics ITEP, Moscow (Russian Federation); Kalaydzhyan, T. [Deutsches Elektronen-Synchrotron (DESY), Hamburg (Germany); Institute for Theoretical and Experimental Physics ITEP, Moscow (Russian Federation); Polikarpov, M.I. [Institute for Theoretical and Experimental Physics ITEP, Moscow (Russian Federation)
2011-11-15
We study the effect of cooling on the spatial distribution of the topological charge density in quenched SU(2) lattice gauge theory with overlap fermions. We show that as the gauge field configurations are cooled, the Hausdorff dimension of regions where the topological charge is localized gradually changes from d=2/3 towards the total space dimension. Hence the cooling procedure destroys some of the essential properties of the topological charge distribution. (orig.)
Indian Academy of Sciences (India)
S Haddad
2010-09-01
The influence of the isovector coupling channel on the central depression parameter and the central value of the charge density distribution in heavy spherical nuclei was studied. The isovector coupling channel leads to about 50% increase of the central depression parameter, and weakens the dependency of both central depression parameter and central density on the asymmetry, impressively contributing to the semibubble form of the charge density distribution in heavy nuclei, and increasing the probability of larger nuclei with higher proton numbers and higher neutron-to-proton ratios stable.
Directory of Open Access Journals (Sweden)
Mokhtaria Drissi
2013-01-01
Full Text Available The molecular electron charge density distribution of the title compound is described accurately using the multipolar model of Hansen and Coppens. The net atomic charge and the in-crystal molecular dipole moment have been determined in order to understand the nature of inter- and intramolecular charge transfer. The study reveals the nature of intermolecular interactions including charge transfer and hydrogen bonds in the title compound. In this crystal, the molecules form dimers via N–HS intermolecular hydrogen bonds. The dimers are further linked by C–HO hydrogen bonds into chains along the c crystallographic axis. This study has also allowed us to determine the electrostatic potential and therefore locate the electropositive part and the electronegative part in molecular scale of the title compound.
Tian, Kai; Cao, Zhou; Xue, Yu-Xiong; Yang, Shi-Yu
2010-01-01
Heavy ions and pulsed lasers are important means to simulate the ionization damage effects on semiconductor materials. The analytic solution of high-energy heavy ion energy loss in silicon has been obtained using the Bethe-Bloch formula and the Kobetich-Katz theory, and some ionization damage parameters of Fe ions in silicon, such as the track structure and ionized charge density distribution, have been calculated and analyzed according to the theoretical calculation results. Using the Gaussian function and Beer's law, the parameters of the track structure and charge density distribution induced by a pulsed laser in silicon have also been calculated and compared with those of Fe ions in silicon, which provides a theoretical basis for ionization damage effect modeling.
Thidé, B; Then, H; Tamburini, F
2010-01-01
Starting from Stratton-Panofsky-Phillips-Jefimenko equations for the electric and magnetic fields generated by completely arbitrary charge and current density distributions at rest, we derive far-zone approximations for the fields, containing all components, dominant as well as sub-dominant. Using these approximate formulas, we derive general formulas for the total electromagnetic linear momentum and angular momentum, valid at large distances from arbitrary, non-moving charge and current sources.
Reinvestigation of the charge density distribution in arc discharge fusion system
Energy Technology Data Exchange (ETDEWEB)
Sheng, Lin Horng; Yee, Lee Kim; Nan, Phua Yeong; Thung, Yong Yun; Khok, Yong Thian; Rahman, Faidz Abd [Centre of Photonics and Advance Material, Universiti Tunku Abdul Rahman Kuala Lumpur (Malaysia)
2015-04-24
A continual arc discharge system has been setup and the light intensity of arc discharge has been profiled. The mathematical model of local energy density distribution in arc discharge fusion has been simulated which is in good qualitative agreement with light intensity profile of arc discharge in the experiments. Eventually, the local energy density distribution of arc discharge system is able to be precisely manipulated to act as heat source in the fabrication of fused fiber devices.
Indian Academy of Sciences (India)
Fauad Rami
2003-05-01
Charged particle pseudorapidity distributions have been measured in Au + Au collisions using the BRAHMS detector at RHIC. The results are presented as a function of the collision centrality and the center of mass energy. They are compared to the predictions of different parton scattering models and the important role of hard scattering processes at RHIC energies is discussed.
Regnier, D; Schunck, N; Verriere, M
2016-01-01
Accurate knowledge of fission fragment yields is an essential ingredient of numerous applications ranging from the formation of elements in the r-process to fuel cycle optimization for nuclear energy. The need for a predictive theory applicable where no data is available is an incentive to develop a fully microscopic approach to fission dynamics. In this work, we calculate the pre-neutron emission charge and mass distributions of the fission fragments formed in the neutron-induced fission of 239Pu using a microscopic method based on nuclear energy density functional (EDF) method, where large amplitude collective motion is treated adiabatically using the time dependent generator coordinate method (TDGCM) under the Gaussian overlap approximation (GOA). Fission fragment distributions are extracted from the flux of the collective wave packet through the scission line. We find that the main characteristics of the fission charge and mass distributions can be well reproduced by existing energy functionals even in tw...
X-ray derived experimental charge density distribution in GaF3 and VF3 solid systems
Sujatha, K.; Israel, S.; Anzline, C.; Niranjana Devi, R.; Sheeba, R. A. J. R.
2016-09-01
The electronic structure and bonding features of metal and transition metal fluorides in low oxidation states, GaF3 and VF3, have been studied from precise single crystal X-ray diffraction data using multipole and maximum entropy methods. The topology of the charge density is analyzed and the (3,-1) bond critical points are determined. Existences of ionic nature of bonding in low valent fluorine compounds are clearly evident. The spherical core of metal atom and aspherical or twisted core of transition metal atom reveal the fact that GaF3 is much more rigid than VF3. Aspherical cores of the polarized ligand atoms are also visible in the two-dimensional density distribution pictures. The true valence charge density surfaces with encapsulating the atomic basins maps are elucidated. An elongated saddle with mid-bond density of 0.6191 e/Å3, observed in the compound VF3, shows that its lattice is less rigid and has more ionic character than GaF3.
Directory of Open Access Journals (Sweden)
GÃƒÂ©rard Vergoten
2007-02-01
Full Text Available At room temperature, the m-Nitrophenol (m-NPH appears in two polymorphicstructures: orthorhombic and monoclinic forms. In the present work, we shall focus on themonoclinic form of this compound which has a centrosymmetric structure with the spacegroup P21/n. The molecular dipole moment has been estimated experimentally. Highresolution single crystal diffraction experiment was performed at low temperature withMoKÃŽÂ± radiation. The crystal structure was refined using the multipolar model of Hansen andCoppens (1978. The molecular electron charge density distribution is described accurately.The study reveals the nature of inter-molecular interactions including charge transfer andhydrogen bonds. In this crystal, hydrogen bonds of moderate strength occur between thehydroxyl group and the O atom in the nitro one.
Liu, Wei; Zhang, Aihua; Zhang, Yan; Wang, Zhong Lin
2016-05-01
The mechanical-electrical coupling properties of piezoelectric semiconductors endow these materials with novel device applications in microelectromechanical systems, sensors, human-computer interfaces, etc. When an applied strain is exerted on a piezoelectric semiconductor, piezoelectric charges are generated at the surface or interface of the semiconductor, which can be utilized to control the electronic transport characteristics. This is the fundamental working mechanism of piezotronic devices, called the piezotronic effect. In the present report, a series of piezotronic transistors composed of different electrode metals and semiconductors is examined using density functional theory calculation. It is found that the influence of semiconductors on the piezotronic effect is larger than the impact of metals, and GaN and CdS are promising candidates for piezotronic and piezo-phototronic devices, respectively. The width of the piezoelectric charge distribution obtained in the present study can be used as a parameter in classical finite-element-method based simulations, which provide guidance on designing high-performance piezotronic devices.
Liu, Wei; Zhang, Aihua; Zhang, Yan; Wang, Zhong Lin
2016-05-20
The mechanical-electrical coupling properties of piezoelectric semiconductors endow these materials with novel device applications in microelectromechanical systems, sensors, human-computer interfaces, etc. When an applied strain is exerted on a piezoelectric semiconductor, piezoelectric charges are generated at the surface or interface of the semiconductor, which can be utilized to control the electronic transport characteristics. This is the fundamental working mechanism of piezotronic devices, called the piezotronic effect. In the present report, a series of piezotronic transistors composed of different electrode metals and semiconductors is examined using density functional theory calculation. It is found that the influence of semiconductors on the piezotronic effect is larger than the impact of metals, and GaN and CdS are promising candidates for piezotronic and piezo-phototronic devices, respectively. The width of the piezoelectric charge distribution obtained in the present study can be used as a parameter in classical finite-element-method based simulations, which provide guidance on designing high-performance piezotronic devices.
Regnier, D.; Dubray, N.; Schunck, N.; Verrière, M.
2016-05-01
Background: Accurate knowledge of fission fragment yields is an essential ingredient of numerous applications ranging from the formation of elements in the r process to fuel cycle optimization for nuclear energy. The need for a predictive theory applicable where no data are available, together with the variety of potential applications, is an incentive to develop a fully microscopic approach to fission dynamics. Purpose: In this work, we calculate the pre-neutron emission charge and mass distributions of the fission fragments formed in the neutron-induced fission of 239Pu using a microscopic method based on nuclear density functional theory (DFT). Methods: Our theoretical framework is the nuclear energy density functional (EDF) method, where large-amplitude collective motion is treated adiabatically by using the time-dependent generator coordinate method (TDGCM) under the Gaussian overlap approximation (GOA). In practice, the TDGCM is implemented in two steps. First, a series of constrained EDF calculations map the configuration and potential-energy landscape of the fissioning system for a small set of collective variables (in this work, the axial quadrupole and octupole moments of the nucleus). Then, nuclear dynamics is modeled by propagating a collective wave packet on the potential-energy surface. Fission fragment distributions are extracted from the flux of the collective wave packet through the scission line. Results: We find that the main characteristics of the fission charge and mass distributions can be well reproduced by existing energy functionals even in two-dimensional collective spaces. Theory and experiment agree typically within two mass units for the position of the asymmetric peak. As expected, calculations are sensitive to the structure of the initial state and the prescription for the collective inertia. We emphasize that results are also sensitive to the continuity of the collective landscape near scission. Conclusions: Our analysis confirms
Charge density waves in solids
Gor'kov, LP
2012-01-01
The latest addition to this series covers a field which is commonly referred to as charge density wave dynamics.The most thoroughly investigated materials are inorganic linear chain compounds with highly anisotropic electronic properties. The volume opens with an examination of their structural properties and the essential features which allow charge density waves to develop.The behaviour of the charge density waves, where interesting phenomena are observed, is treated both from a theoretical and an experimental standpoint. The role of impurities in statics and dynamics is considered and an
Charged-Particle Pseudorapidity Density Distributions from Au+Au Collisions at (sNN) = 130 GeV
Back, B. B.; Baker, M. D.; Barton, D. S.; Betts, R. R.; Bindel, R.; Budzanowski, A.; Busza, W.; Carroll, A.; Decowski, M. P.; Garcia, E.; George, N.; Gulbrandsen, K.; Gushue, S.; Halliwell, C.; Heintzelman, G. A.; Henderson, C.; Hofman, D. J.; Hołyński, R.; Holzman, B.; Johnson, E.; Kane, J. L.; Katzy, J.; Khan, N.; Kucewicz, W.; Kulinich, P.; Lin, W. T.; Manly, S.; McLeod, D.; Michałowski, J.; Mignerey, A. C.; Mülmenstädt, J.; Nouicer, R.; Olszewski, A.; Pak, R.; Park, I. C.; Pernegger, H.; Reed, C.; Remsberg, L. P.; Reuter, M.; Roland, C.; Roland, G.; Rosenberg, L.; Sarin, P.; Sawicki, P.; Skulski, W.; Steadman, S. G.; Steinberg, P.; Stephans, G. S.; Stodulski, M.; Sukhanov, A.; Tang, J.-L.; Teng, R.; Trzupek, A.; Vale, C.; van Nieuwenhuizen, G. J.; Verdier, R.; Wadsworth, B.; Wolfs, F. L.; Wosiek, B.; Woźniak, K.; Wuosmaa, A. H.; Wysłouch, B.
2001-09-01
The charged-particle pseudorapidity density dNch/dη has been measured for Au+Au collisions at (sNN) = 130 GeV at RHIC, using the PHOBOS apparatus. The total number of charged particles produced for the 3% most-central Au+Au collisions for \\|η\\|<=5.4 is found to be 4200+/-470. The evolution of dNch/dη with centrality is discussed, and compared to model calculations and to data from proton-induced collisions. The data show an enhancement in charged-particle production at midrapidity, while in the fragmentation regions, the results are consistent with expectations from pp and pA scattering.
International Nuclear Information System (INIS)
Spectra in the extreme ultraviolet range from 107 to 353 A emitted from Fe ions in various ionization stages have been observed at the Heidelberg electron beam ion trap (EBIT) with a flat-field grating spectrometer. A series of transition lines and their intensities have been analyzed and compared with collisional-radiative simulations. The present collisional-radiative model reproduces well the relative line intensities and facilitates line identification of ions produced in the EBIT. The polarization effect on the line intensities resulting from nonthermal unidirectional electron impact was explored and found to be significant (up to 24%) for a few transition lines. Based upon the observed line intensities, relative charge state distributions (CSD) of ions were determined, which peaked at Fe23+ tailing toward lower charge states. Another simulation on ion charge distributions including the ionization and electron capture processes generated CSDs which are in general agreement with the measurements. By observing intensity ratios of specific lines from levels collisionally populated directly from the ground state and those starting from the metastable levels of Fe XXI, Fe X and other ionic states, the effective electron densities were extracted and found to depend on the ionic charge. Furthermore, it was found that the overlap of the ion cloud with the electron beam estimated from the effective electron densities strongly depends on the charge state of the ion considered, i.e. under the same EBIT conditions, higher charge ions show less expansion in the radial direction.
Microscopic Charge Density Wave Transport
Slot, Erwin
2005-01-01
This thesis describes the work performed on crystals with a phase transition to a Charge-Density Wave (CDW). The electrical transport properties change when crystal sizes are smaller than characteristic length scales for CDWs, typically 1 micrometer. In contrast to metals, semiconductors and superco
Abbas, Ehab; Adam, Jaroslav; Adamova, Dagmar; Adare, Andrew Marshall; Aggarwal, Madan; Aglieri Rinella, Gianluca; Agnello, Michelangelo; Agocs, Andras Gabor; Agostinelli, Andrea; Ahammed, Zubayer; Ahmad, Arshad; Ahmad, Nazeer; Ahn, Sang Un; Ahn, Sul-Ah; Aimo, Ilaria; Ajaz, Muhammad; Akindinov, Alexander; Aleksandrov, Dmitry; Alessandro, Bruno; Alici, Andrea; Alkin, Anton; Almaraz Avina, Erick Jonathan; Alme, Johan; Alt, Torsten; Altini, Valerio; Altinpinar, Sedat; Altsybeev, Igor; Andrei, Cristian; Andronic, Anton; Anguelov, Venelin; Anielski, Jonas; Anson, Christopher Daniel; Anticic, Tome; Antinori, Federico; Antonioli, Pietro; Aphecetche, Laurent Bernard; Appelshauser, Harald; Arbor, Nicolas; Arcelli, Silvia; Arend, Andreas; Armesto, Nestor; Arnaldi, Roberta; Aronsson, Tomas Robert; Arsene, Ionut Cristian; Arslandok, Mesut; Asryan, Andzhey; Augustinus, Andre; Averbeck, Ralf Peter; Awes, Terry; Aysto, Juha Heikki; Azmi, Mohd Danish; Bach, Matthias Jakob; Badala, Angela; Baek, Yong Wook; Bailhache, Raphaelle Marie; Bala, Renu; Baldisseri, Alberto; Baltasar Dos Santos Pedrosa, Fernando; Ban, Jaroslav; Baral, Rama Chandra; Barbera, Roberto; Barile, Francesco; Barnafoldi, Gergely Gabor; Barnby, Lee Stuart; Barret, Valerie; Bartke, Jerzy Gustaw; Basile, Maurizio; Bastid, Nicole; Basu, Sumit; Bathen, Bastian; Batigne, Guillaume; Batyunya, Boris; Batzing, Paul Christoph; Baumann, Christoph Heinrich; Bearden, Ian Gardner; Beck, Hans; Behera, Nirbhay Kumar; Belikov, Iouri; Bellini, Francesca; Bellwied, Rene; Belmont-Moreno, Ernesto; Bencedi, Gyula; Beole, Stefania; Berceanu, Ionela; Bercuci, Alexandru; Berdnikov, Yaroslav; Berenyi, Daniel; Bergognon, Anais Annick Erica; Bertens, Redmer Alexander; Berzano, Dario; Betev, Latchezar; Bhasin, Anju; Bhati, Ashok Kumar; Bhom, Jihyun; Bianchi, Nicola; Bianchi, Livio; Bianchin, Chiara; Bielcik, Jaroslav; Bielcikova, Jana; Bilandzic, Ante; Bjelogrlic, Sandro; Blanco, F; Blanco, Francesco; Blau, Dmitry; Blume, Christoph; Boccioli, Marco; Boettger, Stefan; Bogdanov, Alexey; Boggild, Hans; Bogolyubsky, Mikhail; Boldizsar, Laszlo; Bombara, Marek; Book, Julian; Borel, Herve; Borissov, Alexander; Bossu, Francesco; Botje, Michiel; Botta, Elena; Braidot, Ermes; Braun-Munzinger, Peter; Bregant, Marco; Breitner, Timo Gunther; Broker, Theo Alexander; Browning, Tyler Allen; Broz, Michal; Brun, Rene; Bruna, Elena; Bruno, Giuseppe Eugenio; Budnikov, Dmitry; Buesching, Henner; Bufalino, Stefania; Buncic, Predrag; Busch, Oliver; Buthelezi, Edith Zinhle; Caffarri, Davide; Cai, Xu; Caines, Helen Louise; Calvo Villar, Ernesto; Camerini, Paolo; Canoa Roman, Veronica; Cara Romeo, Giovanni; Carena, Francesco; Carena, Wisla; Carlin Filho, Nelson; Carminati, Federico; Casanova Diaz, Amaya Ofelia; Castillo Castellanos, Javier Ernesto; Castillo Hernandez, Juan Francisco; Casula, Ester Anna Rita; Catanescu, Vasile; Cavicchioli, Costanza; Ceballos Sanchez, Cesar; Cepila, Jan; Cerello, Piergiorgio; Chang, Beomsu; Chapeland, Sylvain; Charvet, Jean-Luc Fernand; Chattopadhyay, Subhasis; Chattopadhyay, Sukalyan; Cherney, Michael Gerard; Cheshkov, Cvetan; Cheynis, Brigitte; Chibante Barroso, Vasco Miguel; Chinellato, David; Chochula, Peter; Chojnacki, Marek; Choudhury, Subikash; Christakoglou, Panagiotis; Christensen, Christian Holm; Christiansen, Peter; Chujo, Tatsuya; Chung, Suh-Urk; Cicalo, Corrado; Cifarelli, Luisa; Cindolo, Federico; Cleymans, Jean Willy Andre; Colamaria, Fabio; Colella, Domenico; Collu, Alberto; Conesa Balbastre, Gustavo; Conesa del Valle, Zaida; Connors, Megan Elizabeth; Contin, Giacomo; Contreras, Jesus Guillermo; Cormier, Thomas Michael; Corrales Morales, Yasser; Cortese, Pietro; Cortes Maldonado, Ismael; Cosentino, Mauro Rogerio; Costa, Filippo; Cotallo, Manuel Enrique; Crescio, Elisabetta; Crochet, Philippe; Cruz Alaniz, Emilia; Cruz Albino, Rigoberto; Cuautle, Eleazar; Cunqueiro, Leticia; Dainese, Andrea; Dalsgaard, Hans Hjersing; Dang, Ruina; Danu, Andrea; Das, Kushal; Das, Indranil; Das, Supriya; Das, Debasish; Dash, Ajay Kumar; Dash, Sadhana; De, Sudipan; de Barros, Gabriel; De Caro, Annalisa; de Cataldo, Giacinto; de Cuveland, Jan; De Falco, Alessandro; De Gruttola, Daniele; Delagrange, Hugues; Deloff, Andrzej; De Marco, Nora; Denes, Ervin; De Pasquale, Salvatore; Deppman, Airton; D'Erasmo, Ginevra; de Rooij, Raoul Stefan; Diaz Corchero, Miguel Angel; Di Bari, Domenico; Dietel, Thomas; Di Giglio, Carmelo; Di Liberto, Sergio; Di Mauro, Antonio; Di Nezza, Pasquale; Divia, Roberto; Djuvsland, Oeystein; Dobrin, Alexandru Florin
2013-01-01
We present the first wide-range measurement of the charged-particle pseudorapidity density distribution, for different centralities (the 0-5%, 5-10%, 10-20%, and 20-30% most central events) in Pb-Pb collisions at $\\sqrt{s_{NN}}$ = 2.76 TeV at the LHC. The measurement is performed using the full coverage of the ALICE detectors, -5.0 < $\\eta$ < 5.5, and employing a special analysis technique based on collisions arising from LHC ' satellite' bunches. We present the pseudorapidity density as a function of the number of participating nucleons as well as an extrapolation to the total number of produced charged particles ($N_{ch}$ = 17165 +/- 772 for the 0-5% most central collisions). From the measured d$N_{ch}$/d$\\eta$ distribution we derive the rapidity density distribution, d$N_{ch}$/dy, under simple assumptions. The rapidity density distribution is found to be significantly wider than the predictions of the Landau model, which reproduce data well at RHIC energies. We assess the validity of longitudinal sca...
Energy Technology Data Exchange (ETDEWEB)
Abbas, E. [Academy of Scientific Research and Technology (ASRT), Cairo (Egypt); Abelev, B. [Lawrence Livermore National Laboratory, Livermore, CA (United States); Adam, J. [Faculty of Nuclear Sciences and Physical Engineering, Czech Technical University in Prague, Prague (Czech Republic); Adamová, D. [Nuclear Physics Institute, Academy of Sciences of the Czech Republic, Řež u Prahy (Czech Republic); Adare, A.M. [Yale University, New Haven, CT (United States); Aggarwal, M.M. [Physics Department, Panjab University, Chandigarh (India); Aglieri Rinella, G. [European Organization for Nuclear Research (CERN), Geneva (Switzerland); Agnello, M. [Sezione INFN, Turin (Italy); Politecnico di Torino, Turin (Italy); Agocs, A.G. [Wigner Research Centre for Physics, Hungarian Academy of Sciences, Budapest (Hungary); Agostinelli, A. [Dipartimento di Fisica e Astronomia dell' Università and Sezione INFN, Bologna (Italy); Ahammed, Z. [Variable Energy Cyclotron Centre, Kolkata (India); Ahmad Masoodi, A.; Ahmad, N. [Department of Physics, Aligarh Muslim University, Aligarh (India); Ahn, S.U.; Ahn, S.A. [Korea Institute of Science and Technology Information, Daejeon (Korea, Republic of); Aimo, I. [Dipartimento di Fisica dell' Università and Sezione INFN, Turin (Italy); Sezione INFN, Turin (Italy); Politecnico di Torino, Turin (Italy); Ajaz, M. [COMSATS Institute of Information Technology (CIIT), Islamabad (Pakistan); Akindinov, A. [Institute for Theoretical and Experimental Physics, Moscow (Russian Federation); Aleksandrov, D. [Russian Research Centre Kurchatov Institute, Moscow (Russian Federation); Alessandro, B. [Sezione INFN, Turin (Italy); and others
2013-11-04
We present the first wide-range measurement of the charged-particle pseudorapidity density distribution, for different centralities (the 0–5%, 5–10%, 10–20%, and 20–30% most central events) in Pb–Pb collisions at √(s{sub NN})=2.76 TeV at the LHC. The measurement is performed using the full coverage of the ALICE detectors, −5.0<η<5.5, and employing a special analysis technique based on collisions arising from LHC ‘satellite’ bunches. We present the pseudorapidity density as a function of the number of participating nucleons as well as an extrapolation to the total number of produced charged particles (N{sub ch}=17165±772 for the 0–5% most central collisions). From the measured dN{sub ch}/dη distribution we derive the rapidity density distribution, dN{sub ch}/dy, under simple assumptions. The rapidity density distribution is found to be significantly wider than the predictions of the Landau model. We assess the validity of longitudinal scaling by comparing to lower energy results from RHIC. Finally the mechanisms of the underlying particle production are discussed based on a comparison with various theoretical models.
Meaningful structural descriptors from charge density.
Stalke, Dietmar
2011-08-16
This paper provides a short introduction to the basics of electron density investigations. The two predominant approaches for the modelling and various interpretations of electron density distributions are presented. Their potential translations into chemical concepts are explained. The focus of the article lies on the deduction of chemical properties from charge density studies in some selected main group compounds. The relationship between the obtained numerical data and commonly accepted simple chemical concepts unfortunately is not always straightforward, and often the chemist relies on heuristic connections rather than rigorously defined ones. This article tries to demonstrate how charge density analyses can shed light on aspects of chemical bonding and reactivity resulting from the determined bonding situation. Sometimes this helps to identify misconceptions and sets the scene for new unconventional synthetic approaches. PMID:21717511
Distributed charging of electrical assets
Energy Technology Data Exchange (ETDEWEB)
Ghosh, Soumyadip; Phan, Dung; Sharma, Mayank; Wu, Chai Wah; Xiong, Jinjun
2016-02-16
The present disclosure relates generally to the field of distributed charging of electrical assets. In various examples, distributed charging of electrical assets may be implemented in the form of systems, methods and/or algorithms.
Charge densities and charge noise in mesoscopic conductors
Indian Academy of Sciences (India)
M Büttiker
2002-02-01
We introduce a hierarchy of density of states to characterize the charge distribution in a mesoscopic conductor. At the bottom of this hierarchy are the partial density of states which represent the contribution to the local density of states if both the incident and the out-going scattering channel is prescribed. The partial density of states play a prominent role in measurements with a scanning tunneling microscope on multiprobe conductors in the presence of current ﬂow. The partial density of states determine the degree of dephasing generated by a weakly coupled voltage probe. In addition the partial density of states determine the frequency-dependent response of mesoscopic conductors in the presence of slowly oscillating voltages applied to the contacts of the sample. The partial density of states permit the formulation of a Friedel sum rule which can be applied locally. We introduce the off-diagonal elements of the partial density of states matrix to describe charge ﬂuctuation processes. This generalization leads to a local Wigner–Smith life-time matrix.
Energy Technology Data Exchange (ETDEWEB)
Migunov, V., E-mail: v.migunov@fz-juelich.de; Dunin-Borkowski, R. E. [Ernst Ruska-Centre for Microscopy and Spectroscopy with Electrons (ER-C) and Peter Grünberg Institute (PGI), Forschungszentrum Jülich, D-52425 Jülich (Germany); London, A. [Department of Materials, University of Oxford, Parks Road, Oxford OX1 3PH (United Kingdom); Farle, M. [Fakultät für Physik and Center of Nanointegration (CeNIDE), Universität Duisburg-Essen, D-47048 Duisburg (Germany)
2015-04-07
The one-dimensional charge density distribution along an electrically biased Fe atom probe needle is measured using a model-independent approach based on off-axis electron holography in the transmission electron microscope. Both the mean inner potential and the magnetic contribution to the phase shift are subtracted by taking differences between electron-optical phase images recorded with different voltages applied to the needle. The measured one-dimensional charge density distribution along the needle is compared with a similar result obtained using model-based fitting of the phase shift surrounding the needle. On the assumption of cylindrical symmetry, it is then used to infer the three-dimensional electric field and electrostatic potential around the needle with ∼10 nm spatial resolution, without needing to consider either the influence of the perturbed reference wave or the extension of the projected potential outside the field of view of the electron hologram. The present study illustrates how a model-independent approach can be used to measure local variations in charge density in a material using electron holography in the presence of additional contributions to the phase, such as those arising from changes in mean inner potential and specimen thickness.
Winters, Caroline; Petrishchev, Vitaly; Yin, Zhiyao; Lempert, Walter R.; Adamovich, Igor V.
2015-10-01
The present work provides insight into surface charge dynamics and kinetics of radical species reactions in nanosecond pulse discharges sustained at a liquid-vapor interface, above a distilled water surface. The near-surface plasma is sustained using two different discharge configurations, a surface ionization wave discharge between two exposed metal electrodes and a double dielectric barrier discharge. At low discharge pulse repetition rates (~100 Hz), residual surface charge deposition after the discharge pulse is a minor effect. At high pulse repetition rates (~10 kHz), significant negative surface charge accumulation over multiple discharge pulses is detected, both during alternating polarity and negative polarity pulse trains. Laser induced fluorescence (LIF) and two-photon absorption LIF (TALIF) line imaging are used for in situ measurements of spatial distributions of absolute OH and H atom number densities in near-surface, repetitive nanosecond pulse discharge plasmas. Both in a surface ionization wave discharge and in a double dielectric barrier discharge, peak measured H atom number density, [H] is much higher compared to peak OH number density, due to more rapid OH decay in the afterglow between the discharge pulses. Higher OH number density was measured near the regions with higher plasma emission intensity. Both OH and especially H atoms diffuse out of the surface ionization wave plasma volume, up to several mm from the liquid surface. Kinetic modeling calculations using a quasi-zero-dimensional H2O vapor / Ar plasma model are in qualitative agreement with the experimental data. The results demonstrate the experimental capability of in situ radical species number density distribution measurements in liquid-vapor interface plasmas, in a simple canonical geometry that lends itself to the validation of kinetic models.
New approach to $^4{He}$ charge distribution
Wilets, L; Pepin, S; Stancu, F; Carlson, J; Koepf, W; Stancu, Fl.
1996-01-01
We present a study of the $^4$He charge distribution based on realistic nucleonic wave functions and incorporation of the nucleon's quark substructure. The central depression of the proton point density seen in modern four-body calculations is too small by itself to lead to a correct description of the charge distribution. We utilize six-quark structures calculated in the Chromodielectric Model for N-N interactions, and we find a swelling of the proton charge distribution as the internucleon distance decreases. These charge distributions are combined with the $^4$He wave function using the Independent Pair Approximation and two-body distributions generated from Green's Function Monte Carlo calculations. We obtain a reasonably good fit to the experimental charge distribution without including meson exchange currents.
International Nuclear Information System (INIS)
We are developing the ultimate non-destructive monitor to measure 6D-phase space charge density distribution of electron bunches shot by shot. Our single-shot 6-D bunch monitor consists of four or six 3-D bunch charge distribution (3D-BCD) monitors based on triplet 3D-BCD elements installed in non-dispersive and dispersive sections of a beam drift transport line. We are planning to use these non-destructive triplet bunch monitor components, not only for a 3-D bunch (3D-BCD) monitor, but also as an electron energy chirping monitor in dispersive sections of the injection line for SPring-8 II from SACLA linac. In 2013, we upgraded the SPring-8 photoinjector test facility to be able to accelerate up to 85 MeV and installed a magnetic chicane to compress bunches down to 30 fs (FWHM). A 3D-BCD monitor evolved from simple encoding of EO sampling into a multiplexing technique with a single probe laser pulse for multiple EO crystal detectors in a manner of spectral decoding (demultiplexing). We realized demultiplexing as an imaging spectrograph with eight-track simultaneous detection in the area array CCD of a high-speed gated I.I. camera. Transverse detections of bunch slices are done by analyzing the higher order moments of the bunch slice charge density distributions. For achieving the upper limit of temporal resolution, we are preparing to combine high-temporal-response EO-detector organic crystals and an octave broadband probe laser pulse with a linear chirp rate of 1 fs/nm. We are developing an EO-probe laser pulse with ∼10 μJ pulse energy and bandwidth over 300 nm (FWHM; flattop spectrum). (author)
Quantum crystallographic charge density of urea
Wall, Michael E.
2016-01-01
Standard X-ray crystallography methods use free-atom models to calculate mean unit-cell charge densities. Real molecules, however, have shared charge that is not captured accurately using free-atom models. To address this limitation, a charge density model of crystalline urea was calculated using high-level quantum theory and was refined against publicly available ultra-high-resolution experimental Bragg data, including the effects of atomic displacement parameters. The resulting quantum crystallographic model was compared with models obtained using spherical atom or multipole methods. Despite using only the same number of free parameters as the spherical atom model, the agreement of the quantum model with the data is comparable to the multipole model. The static, theoretical crystalline charge density of the quantum model is distinct from the multipole model, indicating the quantum model provides substantially new information. Hydrogen thermal ellipsoids in the quantum model were very similar to those obtained using neutron crystallography, indicating that quantum crystallography can increase the accuracy of the X-ray crystallographic atomic displacement parameters. The results demonstrate the feasibility and benefits of integrating fully periodic quantum charge density calculations into ultra-high-resolution X-ray crystallographic model building and refinement. PMID:27437111
Charge density glass from fictions to facts
International Nuclear Information System (INIS)
Thirty years ago Fukuyama [J. Phys. Soc. Jpn. 45 (1978) 1474] predicted a transition from charge density wave (CDW) state to the charge density glass (CDG) at a finite temperature as the consequence of the competition between the uniform commensurability pinning and the random impurity pinning. We present strong evidence that the CDG phase indeed exists as a generic feature of density wave systems. However, it arises from the competition of the random impurity pinning and the electrostatic intra-CDW interaction which tends to establish a uniform phase at low temperature. The glass transition occurs at the temperature at which the free carriers cannot efficiently screen the phase distortions. The characteristic length scale of the disorder, i.e. the size of the phase coherent domains, governs the glass properties
Complexation behavior of oppositely charged polyelectrolytes: Effect of charge distribution
Energy Technology Data Exchange (ETDEWEB)
Zhao, Mingtian; Li, Baohui, E-mail: dliang@pku.edu.cn, E-mail: baohui@nankai.edu.cn [School of Physics and Key Laboratory of Functional Polymer Materials of Ministry of Education, Nankai University, Tianjin 300071 (China); Zhou, Jihan; Su, Cuicui; Niu, Lin; Liang, Dehai, E-mail: dliang@pku.edu.cn, E-mail: baohui@nankai.edu.cn [Beijing National Laboratory for Molecular Sciences and the Key Laboratory of Polymer Chemistry and Physics of Ministry of Education, College of Chemistry and Molecular Engineering, Peking University, Beijing 100871 (China)
2015-05-28
Complexation behavior of oppositely charged polyelectrolytes in a solution is investigated using a combination of computer simulations and experiments, focusing on the influence of polyelectrolyte charge distributions along the chains on the structure of the polyelectrolyte complexes. The simulations are performed using Monte Carlo with the replica-exchange algorithm for three model systems where each system is composed of a mixture of two types of oppositely charged model polyelectrolyte chains (EGEG){sub 5}/(KGKG){sub 5}, (EEGG){sub 5}/(KKGG){sub 5}, and (EEGG){sub 5}/(KGKG){sub 5}, in a solution including explicit solvent molecules. Among the three model systems, only the charge distributions along the chains are not identical. Thermodynamic quantities are calculated as a function of temperature (or ionic strength), and the microscopic structures of complexes are examined. It is found that the three systems have different transition temperatures, and form complexes with different sizes, structures, and densities at a given temperature. Complex microscopic structures with an alternating arrangement of one monolayer of E/K monomers and one monolayer of G monomers, with one bilayer of E and K monomers and one bilayer of G monomers, and with a mixture of monolayer and bilayer of E/K monomers in a box shape and a trilayer of G monomers inside the box are obtained for the three mixture systems, respectively. The experiments are carried out for three systems where each is composed of a mixture of two types of oppositely charged peptide chains. Each peptide chain is composed of Lysine (K) and glycine (G) or glutamate (E) and G, in solution, and the chain length and amino acid sequences, and hence the charge distribution, are precisely controlled, and all of them are identical with those for the corresponding model chain. The complexation behavior and complex structures are characterized through laser light scattering and atomic force microscopy measurements. The order
Complexation behavior of oppositely charged polyelectrolytes: Effect of charge distribution
International Nuclear Information System (INIS)
Complexation behavior of oppositely charged polyelectrolytes in a solution is investigated using a combination of computer simulations and experiments, focusing on the influence of polyelectrolyte charge distributions along the chains on the structure of the polyelectrolyte complexes. The simulations are performed using Monte Carlo with the replica-exchange algorithm for three model systems where each system is composed of a mixture of two types of oppositely charged model polyelectrolyte chains (EGEG)5/(KGKG)5, (EEGG)5/(KKGG)5, and (EEGG)5/(KGKG)5, in a solution including explicit solvent molecules. Among the three model systems, only the charge distributions along the chains are not identical. Thermodynamic quantities are calculated as a function of temperature (or ionic strength), and the microscopic structures of complexes are examined. It is found that the three systems have different transition temperatures, and form complexes with different sizes, structures, and densities at a given temperature. Complex microscopic structures with an alternating arrangement of one monolayer of E/K monomers and one monolayer of G monomers, with one bilayer of E and K monomers and one bilayer of G monomers, and with a mixture of monolayer and bilayer of E/K monomers in a box shape and a trilayer of G monomers inside the box are obtained for the three mixture systems, respectively. The experiments are carried out for three systems where each is composed of a mixture of two types of oppositely charged peptide chains. Each peptide chain is composed of Lysine (K) and glycine (G) or glutamate (E) and G, in solution, and the chain length and amino acid sequences, and hence the charge distribution, are precisely controlled, and all of them are identical with those for the corresponding model chain. The complexation behavior and complex structures are characterized through laser light scattering and atomic force microscopy measurements. The order of the apparent weight-averaged molar
Complexation behavior of oppositely charged polyelectrolytes: Effect of charge distribution
Zhao, Mingtian; Zhou, Jihan; Su, Cuicui; Niu, Lin; Liang, Dehai; Li, Baohui
2015-05-01
Complexation behavior of oppositely charged polyelectrolytes in a solution is investigated using a combination of computer simulations and experiments, focusing on the influence of polyelectrolyte charge distributions along the chains on the structure of the polyelectrolyte complexes. The simulations are performed using Monte Carlo with the replica-exchange algorithm for three model systems where each system is composed of a mixture of two types of oppositely charged model polyelectrolyte chains (EGEG)5/(KGKG)5, (EEGG)5/(KKGG)5, and (EEGG)5/(KGKG)5, in a solution including explicit solvent molecules. Among the three model systems, only the charge distributions along the chains are not identical. Thermodynamic quantities are calculated as a function of temperature (or ionic strength), and the microscopic structures of complexes are examined. It is found that the three systems have different transition temperatures, and form complexes with different sizes, structures, and densities at a given temperature. Complex microscopic structures with an alternating arrangement of one monolayer of E/K monomers and one monolayer of G monomers, with one bilayer of E and K monomers and one bilayer of G monomers, and with a mixture of monolayer and bilayer of E/K monomers in a box shape and a trilayer of G monomers inside the box are obtained for the three mixture systems, respectively. The experiments are carried out for three systems where each is composed of a mixture of two types of oppositely charged peptide chains. Each peptide chain is composed of Lysine (K) and glycine (G) or glutamate (E) and G, in solution, and the chain length and amino acid sequences, and hence the charge distribution, are precisely controlled, and all of them are identical with those for the corresponding model chain. The complexation behavior and complex structures are characterized through laser light scattering and atomic force microscopy measurements. The order of the apparent weight-averaged molar
Charge and Size Distributions of Electrospray Drops
de Juan L; de la Mora JF
1997-02-15
The distributions of charge q and diameter d of drops emitted from electrified liquid cones in the cone-jet mode are investigated with two aerosol instruments. A differential mobility analyzer (DMA, Vienna type) first samples the spray drops, selects those with electrical mobilities within a narrow band, and either measures the associated current or passes them to a second instrument. The drops may also be individually counted optically and sized by sampling them into an aerodynamic size spectrometer (API's Aerosizer). For a given cone-jet, the distribution of charge q for the main electrospray drops is some 2.5 times broader than their distribution of diameters d, with qmax/qmin approximately 4. But mobility-selected drops have relative standard deviations of only 5% for both d and q, showing that the support of the (q, d) distribution is a narrow band centered around a curve q(d). The approximate one-dimensionality of this support region is explained through the mechanism of jet breakup, which is a random process with only one degree of freedom: the wavelength of axial modulation of the jet. The observed near constancy of the charge over volume ratio (q approximately d3) shows that the charge is frozen in the liquid surface at the time scale of the breakup process. The charge over volume ratio of the primary drops varies between 98 and 55% of the ratio of spray current I over liquid flow rate Q, and decreases at increasing Q. I/Q is therefore an unreliable measure of the charge density of these drops.
Determination of charge densities in ReO3
International Nuclear Information System (INIS)
The charge densities in ReO3 were investigated by the x-ray structural analysis. The anisotropic charge distributions were found around a Re atom, which is attributable to the π bond formed by Re 5d (tsub(2g) and O 2p electrons. The calculated difference electron density map by the DV-Xα cluster method supports qualitatively the present observation. The measured thermal vibrations of oxygen atoms were highly anisotropic. The M-mode oxygen displacements will be readily enhanced by the existence of high pressures. (author)
Nuclear charge radii: Density functional theory meets Bayesian neural networks
Utama, Raditya; Piekarewicz, Jorge
2016-01-01
The distribution of electric charge in atomic nuclei is fundamental to our understanding of the complex nuclear dynamics and a quintessential observable to validate nuclear structure models. We explore a novel approach that combines sophisticated models of nuclear structure with Bayesian neural networks (BNN) to generate predictions for the charge radii of thousands of nuclei throughout the nuclear chart. A class of relativistic energy density functionals is used to provide robust predictions for nuclear charge radii. In turn, these predictions are refined through Bayesian learning for a neural network that is trained using residuals between theoretical predictions and the experimental data. Although predictions obtained with density functional theory provide a fairly good description of experiment, our results show significant improvement (better than 40%) after BNN refinement. Moreover, these improved results for nuclear charge radii are supplemented with theoretical error bars. We have successfully demonst...
Density functional theory of charged colloidal systems
International Nuclear Information System (INIS)
The phase behavior of charged colloidal systems has been studied recently by the density functional theory formalism (DFT) [R. van Roij, M. Dijkstra, and J. P. Hansen, Phys. Rev. E >59, 2010 (1999)]. A key feature of this approach is the appearance of a density and temperature-dependent effective Hamiltonian between the charged colloids. Under certain approximations, the effective Hamiltonian is made up only of a sum of position-independent one-body or volume terms and two-body colloid-separation dependent terms. In the limit of low colloidal densities, the DFT results do not reduce to the familiar Debye-Huckel limiting law nor do the results agree with previous work based on an identical approach but were developed using traditional statistical-mechanical methods [B. Beresford-Smith, D. Y. C. Chan, and D. J. Mitchell J. Colloid Interface Sci. >105, 216 (1985)]. This paper provides a reconciliation of these differences and comments on the significance of the one-body volume terms in the effective Hamiltonian of a system of charged colloids in determining thermodynamics and phase behavior
Contributions of charge-density research to medicinal chemistry
Directory of Open Access Journals (Sweden)
Birger Dittrich
2014-11-01
Full Text Available This article reviews efforts in accurate experimental charge-density studies with relevance to medicinal chemistry. Initially, classical charge-density studies that measure electron density distribution via least-squares refinement of aspherical-atom population parameters are summarized. Next, interaction density is discussed as an idealized situation resembling drug–receptor interactions. Scattering-factor databases play an increasing role in charge-density research, and they can be applied both to small-molecule and macromolecular structures in refinement and analysis; software development facilitates their use. Therefore combining both of these complementary branches of X-ray crystallography is recommended, and examples are given where such a combination already proved useful. On the side of the experiment, new pixel detectors are allowing rapid measurements, thereby enabling both high-throughput small-molecule studies and macromolecular structure determination to higher resolutions. Currently, the most ambitious studies compute intermolecular interaction energies of drug–receptor complexes, and it is recommended that future studies benefit from recent method developments. Selected new developments in theoretical charge-density studies are discussed with emphasis on its symbiotic relation to crystallography.
Charge distribution over dust particles configured with size distribution in a complex plasma
Misra, Shikha; Mishra, Sanjay K.
2016-02-01
A theoretical kinetic model describing the distribution of charge on the dust particles configured with generalized Kappa size distribution in a complex plasma has been developed. The formulation is based on the manifestation of uniform potential theory with an analytical solution of the master differential equation for the probability density function of dust charge; the number and energy balance of the plasma constituents are utilized in writing the kinetic equations. A parametric study to determine the steady state plasma parameters and the charge distribution corresponding to a size distribution of dust grains in the complex plasma has been made; the numerical results are presented graphically. The charge distribution is seen sensitive to the population of small grains in the particle size distribution and thus in contrast to symmetrical distribution of charge around a mean value for uniform sized grains, the charge distribution in the present case peaks around lower charge.
Pion transverse charge density and the edge of hadrons
Energy Technology Data Exchange (ETDEWEB)
Carmignotto, Marco [Catholic University of America; Horn, Tanja [Catholic University of America; Miller, Gerald A. [University of Washington
2014-08-01
We use the world data on the pion form factor for space-like kinematics and a technique used to extract the proton transverse densities, to extract the transverse pion charge density and its uncertainty due to experimental uncertainties and incomplete knowledge of the pion form factor at large values of Q2. The pion charge density at small values of b<0.1 fm is dominated by this incompleteness error while the range between 0.1-0.3 fm is relatively well constrained. A comparison of pion and proton charge densities shows that the pion is denser than the proton for values of b<0.2 fm. The pion and proton distributions seem to be the same for values of b=0.2-0.6 fm. Future data from Jlab 12 GeV and the EIC will increase the dynamic extent of the data to higher values of Q2 and thus reduce the uncertainties in the extracted pion charge density.
A Duality Between Unidirectional Charge Density Wave Order and Superconductivity
Lee, Dung-Hai
2001-01-01
This paper shows the existence of a duality between an unidirectional charge density wave order and a superconducting order. This duality predicts the existence of charge density wave near a superconducting vortex, and the existence of superconductivity near a charge density wave dislocation.
Density Distributions of Cyclotrimethylenetrinitramines (RDX)
Energy Technology Data Exchange (ETDEWEB)
Hoffman, D M
2002-03-19
As part of the US Army Foreign Comparative Testing (FCT) program the density distributions of six samples of class 1 RDX were measured using the density gradient technique. This technique was used in an attempt to distinguish between RDX crystallized by a French manufacturer (designated insensitive or IRDX) from RDX manufactured at Holston Army Ammunition Plant (HAAP), the current source of RDX for Department of Defense (DoD). Two samples from different lots of French IRDX had an average density of 1.7958 {+-} 0.0008 g/cc. The theoretical density of a perfect RDX crystal is 1.806 g/cc. This yields 99.43% of the theoretical maximum density (TMD). For two HAAP RDX lots the average density was 1.786 {+-} 0.002 g/cc, only 98.89% TMD. Several other techniques were used for preliminary characterization of one lot of French IRDX and two lot of HAAP RDX. Light scattering, SEM and polarized optical microscopy (POM) showed that SNPE and Holston RDX had the appropriate particle size distribution for Class 1 RDX. High performance liquid chromatography showed quantities of HMX in HAAP RDX. French IRDX also showed a 1.1 C higher melting point compared to HAAP RDX in the differential scanning calorimetry (DSC) consistent with no melting point depression due to the HMX contaminant. A second part of the program involved characterization of Holston RDX recrystallized using the French process. After reprocessing the average density of the Holston RDX was increased to 1.7907 g/cc. Apparently HMX in RDX can act as a nucleating agent in the French RDX recrystallization process. The French IRDX contained no HMX, which is assumed to account for its higher density and narrower density distribution. Reprocessing of RDX from Holston improved the average density compared to the original Holston RDX, but the resulting HIRDX was not as dense as the original French IRDX. Recrystallized Holston IRDX crystals were much larger (3-500 {micro}m or more) then either the original class 1 HAAP RDX or
Charge Exchange Effect on Space-Charge-Limited Current Densities in Ion Diode
Institute of Scientific and Technical Information of China (English)
石磊
2002-01-01
The article theoretically studied the charge-exchange effects on space charge limited electron and ion current densities of non-relativistic one-dimensional slab ion diode, and compared with those of without charge exchange.
Density Matrix for Mesoscopic Distributed Parameter Circuits
Institute of Scientific and Technical Information of China (English)
JI Ying-Hua; WANG Qi; LUO Hai-Mei; LEI Min-Sheng
2005-01-01
Under the Born-von-Karmann periodic boundary condition, we propose a quantization scheme for nondissipative distributed parameter circuits (i.e. a uniform periodic transmission line). We find the unitary operator for diagonalizing the Hamiltonian of the uniform periodic transmission line. The unitary operator is expressed in a coordinate representation that brings convenience to deriving the density matrix p(q, q',β). The quantum fluctuations of charge and current at a definite temperature have been studied. It is shown that quantum fluctuations of distributed parameter circuits, which also have distributed properties, are related to both the circuit parameters and the positions and the mode of signals and temperature T. The higher the temperature is, the stronger quantum noise the circuit exhibits.
Charge distribution and stability in electret materials
DEFF Research Database (Denmark)
Thyssen, Anders
The objective of the work presented in this Ph.D. thesis is to give a broader understanding of which key parameters influence the charge stability of polymer electrets, and how the electrical charges are distributed. This has been achieved using polypropylene as an electret polymer model system. ...
On equilibrium charge distribution above dielectric surface
Directory of Open Access Journals (Sweden)
Yu.V. Slyusarenko
2009-01-01
Full Text Available The problem of the equilibrium state of the charged many-particle system above dielectric surface is formulated. We consider the case of the presence of the external attractive pressing field and the case of its absence. The equilibrium distributions of charges and the electric field, which is generated by these charges in the system in the case of ideally plane dielectric surface, are obtained. The solution of electrostatic equations of the system under consideration in case of small spatial heterogeneities caused by the dielectric surface, is also obtained. These spatial inhomogeneities can be caused both by the inhomogeneities of the surface and by the inhomogeneous charge distribution upon it. In particular, the case of the "wavy" spatially periodic surface is considered taking into account the possible presence of the surface charges.
On the charge density and asymptotic tail of a monopole
Harland, Derek
2015-01-01
We propose a new definition for the abelian magnetic charge density of a non-abelian monopole, based on zero-modes of an associated Dirac operator. Unlike the standard definition of the charge density, this density is smooth in the core of the monopole. We show that this charge density induces a magnetic field whose expansion in powers of 1/r agrees with that of the conventional asymptotic magnetic field to all orders. We also show that the asymptotic field can be easily calculated from the spectral curve. Explicit examples are given for known monopole solutions.
Charge density fluctuation of low frequency in a dusty plasma
Institute of Scientific and Technical Information of China (English)
李芳; 吕保维; O.Havnes
1997-01-01
The charge density fluctuation of low frequency in a dusty plasma, which is derived from the longitudinal dielectric permittivity of the dusty plasma, has been studied by kinetic theory. The results show that the P value, which describes the relative charge density on the dust in the plasma, and the charging frequency of a dust particle Ωc, which describes the ratio of charge changing of the dust particles, determine the character of the charge density fluctuation of low frequency. For a dusty plasma of P<<1, when the charging frequency Ωc is much smaller than the dusty plasma frequency wd, there is a strong charge density fluctuation which is of character of dust acoustic eigen wave. For a dusty plasma of P>>1, when the frequency Ωc, is much larger than wd there are weaker fluctuations with a wide spectrum. The results have been applied to the ionosphere and the range of radius and density of dust particles is found, where a strong charge density fluctuation of low frequency should exist.
Inhomogeneity of charge-density-wave order and quenched disorder in a high-Tc superconductor
Campi, G.; Bianconi, A.; Poccia, N.; Bianconi, G.; Barba, L.; Arrighetti, G.; Innocenti, D.; Karpinski, J.; Zhigadlo, N. D.; Kazakov, S. M.; Burghammer, M.; Zimmermann, M. V.; Sprung, M.; Ricci, A.
2015-09-01
It has recently been established that the high-transition-temperature (high-Tc) superconducting state coexists with short-range charge-density-wave order and quenched disorder arising from dopants and strain. This complex, multiscale phase separation invites the development of theories of high-temperature superconductivity that include complexity. The nature of the spatial interplay between charge and dopant order that provides a basis for nanoscale phase separation remains a key open question, because experiments have yet to probe the unknown spatial distribution at both the nanoscale and mesoscale (between atomic and macroscopic scale). Here we report micro X-ray diffraction imaging of the spatial distribution of both short-range charge-density-wave `puddles' (domains with only a few wavelengths) and quenched disorder in HgBa2CuO4 + y, the single-layer cuprate with the highest Tc, 95 kelvin (refs 26, 27, 28). We found that the charge-density-wave puddles, like the steam bubbles in boiling water, have a fat-tailed size distribution that is typical of self-organization near a critical point. However, the quenched disorder, which arises from oxygen interstitials, has a distribution that is contrary to the usually assumed random, uncorrelated distribution. The interstitial-oxygen-rich domains are spatially anticorrelated with the charge-density-wave domains, because higher doping does not favour the stripy charge-density-wave puddles, leading to a complex emergent geometry of the spatial landscape for superconductivity.
Inhomogeneity of charge-density-wave order and quenched disorder in a high-Tc superconductor.
Campi, G; Bianconi, A; Poccia, N; Bianconi, G; Barba, L; Arrighetti, G; Innocenti, D; Karpinski, J; Zhigadlo, N D; Kazakov, S M; Burghammer, M; Zimmermann, M v; Sprung, M; Ricci, A
2015-09-17
It has recently been established that the high-transition-temperature (high-Tc) superconducting state coexists with short-range charge-density-wave order and quenched disorder arising from dopants and strain. This complex, multiscale phase separation invites the development of theories of high-temperature superconductivity that include complexity. The nature of the spatial interplay between charge and dopant order that provides a basis for nanoscale phase separation remains a key open question, because experiments have yet to probe the unknown spatial distribution at both the nanoscale and mesoscale (between atomic and macroscopic scale). Here we report micro X-ray diffraction imaging of the spatial distribution of both short-range charge-density-wave 'puddles' (domains with only a few wavelengths) and quenched disorder in HgBa2CuO4 + y, the single-layer cuprate with the highest Tc, 95 kelvin (refs 26-28). We found that the charge-density-wave puddles, like the steam bubbles in boiling water, have a fat-tailed size distribution that is typical of self-organization near a critical point. However, the quenched disorder, which arises from oxygen interstitials, has a distribution that is contrary to the usually assumed random, uncorrelated distribution. The interstitial-oxygen-rich domains are spatially anticorrelated with the charge-density-wave domains, because higher doping does not favour the stripy charge-density-wave puddles, leading to a complex emergent geometry of the spatial landscape for superconductivity. PMID:26381983
Institute of Scientific and Technical Information of China (English)
穆海宝; 张冠军
2011-01-01
Surface charges greatly affect the discharge/flashover development process across an insulator. The relationship between surface charge distribution on insulating materials and measurement data based on Pockels technique is discussed, and an improved algorithm is built to calculate the real surface charge density from original data. In this algorithm, two-dimensional Fourier transform technique and Wiener filter are employed to reduce the amount of numerical calculation and improve the stability of computation, Moreover, this algorithm considers not only the influence of sample＇s thickness and permittivity, but also the impact of charges at different positions. The achievement of this calibration algorithm is demonstrated in details. Compared with traditional algorithms, the improved one supplies a better solution in the calibration of surface charge distribution on different samples with different thickness.
The Charge Density and Electrostatic Potential of Three Dinitramide Salts
Martin, Anthony
The aim of this dissertation was to obtain information about the redistribution of electrons due to effects such as chemical bonding using X-ray diffraction. There is a great deal of current interest in the production of new energetic materials. A new class of the salts based on the dinitramide anion, N(NO _2)_sp{2}{-}, DN has attracted some interest. Three dinitramide salts (ammonium, monoprotonated and diprotonated biguanidinium) have been selected for charge density analyses on the basis of the observed variation of the dinitramide anion in the room temperature structures and the potential applications of these compounds. However, while a good deal of work has gone into the methodology of charge density studies, relatively little has been done to improve the presentation of the results. As a result the quality of presentation has remained essentially unchanged for twenty years. While this may sound like a triviality, it is visualization of data that produces information. Existing programs have been modified to produce output suitable for improved visualization, in particular using color and 3D computer graphics. From a chemist's viewpoint there were two aims for this project. The first was to see if the difference in the geometries of the dinitramide ion is reflected in the size and shape of the bonding electron density using experimental methods. The second aim was to obtain the electrostatic potential of the materials based on the experimentally determined electron density distribution in order to obtain some insight into the reactivity of the dinitramide ion. The different geometries produce observable differences in the deformation density. The electrostatic potential derived from the experimental electron density also shows variations with respect to the geometry and environment. These potentials have different minima and are also different from potentials produced from gas phase semi-empirical and ab-initio calculations. Whether the reactivity can be
Distribution of vacuum charge near supercharged nuclei
Energy Technology Data Exchange (ETDEWEB)
Migdal, A.B.; Voskresenskii, D.N.; Popov, V.S.
1976-08-05
We obtain the distribution of the charge produced near supercritical nuclei (Ze/sup 2/..integral integral.. 1) as a result of the restructuring of the electron-positron vacuum. The calculation is carried out in the Thomas-Fermi approximation.
The density curve of F distribution
Institute of Scientific and Technical Information of China (English)
LIU Xiaopeng; LIU Kunhui
2004-01-01
Employing the properties of special function,we discuss the positional relation between two density curves with different parameters for F distribution in this paper.Some varying regularities about the position of density curve of F distribution have been obtained.
Kim, Eungtaek; Kim, Choong-Ki; Lee, Myung Keun; Bang, Tewook; Choi, Yang-Kyu; Park, Sang-Hee Ko; Choi, Kyung Cheol
2016-05-01
We investigated the positive-bias stress (PBS) instability of thin film transistors (TFTs) composed of different types of first-gate insulators, which serve as a protection layer of the active surface. Two different deposition methods, i.e., the thermal atomic layer deposition (THALD) and plasma-enhanced ALD (PEALD) of Al2O3, were applied for the deposition of the first GI. When THALD was used to deposit the GI, amorphous indium-gallium-zinc oxide (a-IGZO) TFTs showed superior stability characteristics under PBS. For example, the threshold voltage shift (ΔVth) was 0 V even after a PBS time (tstress) of 3000 s under a gate voltage (VG) condition of 5 V (with an electrical field of 1.25 MV/cm). On the other hand, when the first GI was deposited by PEALD, the ΔVth value of a-IGZO TFTs was 0.82 V after undergoing an identical amount of PBS. In order to interpret the disparate ΔVth values resulting from PBS quantitatively, the average oxide charge trap density (NT) in the GI and its spatial distribution were investigated through low-frequency noise characterizations. A higher NT resulted during in the PEALD type GI than in the THALD case. Specifically, the PEALD process on a-IGZO layer surface led to an increasing trend of NT near the GI/a-IGZO interface compared to bulk GI owing to oxygen plasma damage on the a-IGZO surface.
Do plasma proteins distinguish between liposomes of varying charge density?
Capriotti, Anna Laura
2012-03-01
Cationic liposomes (CLs) are one of the most employed nonviral nanovector systems in gene therapy. However, their transfection efficiency is strongly affected by interactions with plasma components, that lead to the formation of a "protein corona" onto CL surface. The interactions between nanoparticles entering the body and biomolecules have an essential role for their biodistribution. Because the knowledge of proteins adsorbed onto vector surface could be useful in the screening of new, more efficient and more biocompatible liposomal formulations, the behavior of three CLs with different membrane charge densities was investigated. The proteins of the three coronas were identified by nano-liquid chromatography-tandem mass spectrometry, and quantified with label-free spectral counting strategy. Fibrinogen displayed higher association with CLs with high membrane charge density, while apolipoproteins and C4b-binding protein with CLs with low membrane charge density. These results are discussed in terms of the different lipid compositions of CLs and may have a deep biological impact for in vivo applications. Surface charge of nanoparticles is emerging as a relevant factor determining the corona composition after interaction with plasma proteins. Remarkably, it is also shown that the charge of the protein corona formed around CLs is strongly related to their membrane charge density. © 2012 Elsevier B.V.
Lower Atmospheric Electric Field due to Cloud Charge Distribution
Paul, Suman; Haldar, Dilip kumar; Sundar De, Syam; Ghosh, Abhijit; Hazra, Pranab; Bandyopadhyay, Bijoy
2016-07-01
The distributions of electric charge in the electrified clouds introduce important effects in the ionosphere and into the region between the ionosphere and the Earth. The electrical properties of the medium are changed greatly between thundercloud altitudes and the magnetosphere. A model for the penetration of DC thundercloud electric field between the Earth's upper and lower atmosphere has been presented here. The model deals with the electromagnetic responses of the atmosphere simulated through Maxwell's equations together with a time-varying source charge distribution. The modified ellipsoidal-Gaussian profile has been taken for the charge distribution of the electrified cloud. The conductivity profile of the medium is taken to be isotropic below 70 km height and anisotropic above 70 km. The Earth's surface is considered to be perfectly conducting. A general form of equation representing the thundercloud electric field component is deduced. In spite of assumptions for axial symmetry of thundercloud charge distribution considered in the model, the results are obtained giving the electric field variation in the upper atmosphere. The vertical component of the electric field would relate the global electric circuit while the radial component showed the electrical coupling between the lower atmosphere and the ionized Earth's environment. The variations of the values of field components for different heights as well as Maxwell's current have been evaluated. Coupling between the troposphere and the ionosphere is critically dependent on the height variations of electrical conductivity. Field-aligned electron density irregularities in the ionosphere may be investigated through the present analyses.
Breathing Charge Density Waves in Intrinsic Josephson Junctions
Shukrinov, Yu M.; Abdelhafiz, H.
2013-01-01
We demonstrate the creation of a charge density wave (CDW) along a stack of coupled Josephson junctions in layered superconductors. Electric charge in each superconducting layer oscillates around some average value, forming a breathing CDW. We show the transformation of a longitudinal plasma wave to CDW in the state corresponding to the outermost branch. Transitions between different types of CDW's related to the inner branches of current voltage characteristics are demonstrated. The effect o...
Indian Academy of Sciences (India)
K B Joshi; Nishant N Patel
2008-02-01
Charge density calculations and electronic band structures for GaAl1- = 1.0, 0.5 and 0.0 are presented in this work. The calculations are performed using the empirical pseudopotential method. The charge density is computed for a number of planes, i.e. = 0:0, 0.125 and 0.25 0 by generating the potential through a number of potential parameters available in the literature. The virtual crystal approximation was applied for the semiconducting alloy. The characteristics of the band structure and charge density are observed to be affected by the potential parameters. Calculated band gaps and the nature of gaps are in good agreement with the experimental data reported. The ionicity is also reasonably in good agreement with other scales proposed in the literature; however the formulation needs to be improved. The present work also demands indirect experimental band gap for the alloy.
Numerical calculation of impurity charge state distributions
Energy Technology Data Exchange (ETDEWEB)
Crume, E. C.; Arnurius, D. E.
1977-09-01
The numerical calculation of impurity charge state distributions using the computer program IMPDYN is discussed. The time-dependent corona atomic physics model used in the calculations is reviewed, and general and specific treatments of electron impact ionization and recombination are referenced. The complete program and two examples relating to tokamak plasmas are given on a microfiche so that a user may verify that his version of the program is working properly. In the discussion of the examples, the corona steady-state approximation is shown to have significant defects when the plasma environment, particularly the electron temperature, is changing rapidly.
Branched–linear polyion complexes at variable charge densities
International Nuclear Information System (INIS)
Structural behavior of complexes formed by a charged and branched copolymer and an oppositely charged and linear polyion was examined by Monte Carlo simulations employing a coarse-grained bead–spring model. The fractional bead charge and the branching density were systematically varied; the former between 0e and 1e and the latter such that both the comb-polymer and the bottle-brush limits were included. The number of beads of the main chain of the branched copolymer and of the linear polyion was always kept constant and equal, and a single side-chain length was used. Our analysis involved characterization of the complex as well as investigation of size, shape, and flexibility of the charged moieties. An interplay between Coulomb interaction and side-chain repulsion governed the structure of the polyion complex. At strong Coulomb interaction, the complexes underwent a gradual transition from a globular structure at low branching density to an extended one at high branching density. As the electrostatic coupling was decreased, the transition was smoothened and shifted to lower branching density, and, eventually, a behavior similar to that found for neutral branched polymer was observed. Structural analogies and dissimilarities with uncharged branched polymers in poor solutions are discussed. (paper)
Gate effect in charge-density wave nanowires
Slot, E.; Holst, M.A.; Van der Zant, H.S.J.
2005-01-01
We have investigated transport characteristics of charge-density wave nanowires with a few hundred parallel chains. At temperatures below50K, these samples show power-law behavior in temperature and voltage, characteristic for one-dimensional transport. In this regime, gate dependent transport has b
Pressure induced Superconductivity in the Charge Density Wave Compound Tritelluride
Energy Technology Data Exchange (ETDEWEB)
Hamlin, J.J.; Zocco, D.A.; Sayles, T.A.; Maple, M.B.; /UC, Davis; Chu, J.-H.; Fisher, I.R.; /Stanford U., Geballe Lab.
2010-02-15
A series of high-pressure electrical resistivity measurements on single crystals of TbTe{sub 3} reveal a complex phase diagram involving the interplay of superconducting, antiferromagnetic and charge density wave order. The onset of superconductivity reaches a maximum of almost 4 K (onset) near {approx} 12.4 GPa.
Charge density wave dynamics from ultrafast XUV ARPES
Directory of Open Access Journals (Sweden)
Frassetto F.
2013-03-01
Full Text Available Ultrafast angle–resolved XUV photoemission reveals the time- and momentum-dependent electronic structure of 1T–TaS2, a hybrid Mott and charge-density-wave insulator. Both electronic orderings melt well before the lattice responds, suggesting that electronic correlations play a role not just in the Mott localization but in the CDW ordering as well.
Beyond Poisson-Boltzmann: Numerical Sampling of Charge Density Fluctuations.
Poitevin, Frédéric; Delarue, Marc; Orland, Henri
2016-07-01
We present a method aimed at sampling charge density fluctuations in Coulomb systems. The derivation follows from a functional integral representation of the partition function in terms of charge density fluctuations. Starting from the mean-field solution given by the Poisson-Boltzmann equation, an original approach is proposed to numerically sample fluctuations around it, through the propagation of a Langevin-like stochastic partial differential equation (SPDE). The diffusion tensor of the SPDE can be chosen so as to avoid the numerical complexity linked to long-range Coulomb interactions, effectively rendering the theory completely local. A finite-volume implementation of the SPDE is described, and the approach is illustrated with preliminary results on the study of a system made of two like-charge ions immersed in a bath of counterions. PMID:27075231
Plasma Diagnostics by the Charge Distributions of Heavy Ions in Impulsive Solar Flares
Kartavykh, Julia
We consider stochastic acceleration of heavy ions (Fe as a sample species) by the Alfven wave turbulence in impulsive solar flares. The processes of Coulomb losses and ion stripping during the energy gain are taken into account. The properties of charge distribution function are influenced by the plasma parameters such as temperature, number density and spectral index of turbulence. General dependences of the mean charge, dispersion and asymmetry of charge distribution on plasma parameters are investigated. These simulations could be important in the light of new experimental data from ACE spacecraft that is able to measure charge distribution for an individual impulsive event.
Ionic strength independence of charge distributions in solvation of biomolecules.
Virtanen, J J; Sosnick, T R; Freed, K F
2014-12-14
Electrostatic forces enormously impact the structure, interactions, and function of biomolecules. We perform all-atom molecular dynamics simulations for 5 proteins and 5 RNAs to determine the dependence on ionic strength of the ion and water charge distributions surrounding the biomolecules, as well as the contributions of ions to the electrostatic free energy of interaction between the biomolecule and the surrounding salt solution (for a total of 40 different biomolecule/solvent combinations). Although water provides the dominant contribution to the charge density distribution and to the electrostatic potential even in 1M NaCl solutions, the contributions of water molecules and of ions to the total electrostatic interaction free energy with the solvated biomolecule are comparable. The electrostatic biomolecule/solvent interaction energies and the total charge distribution exhibit a remarkable insensitivity to salt concentrations over a huge range of salt concentrations (20 mM to 1M NaCl). The electrostatic potentials near the biomolecule's surface obtained from the MD simulations differ markedly, as expected, from the potentials predicted by continuum dielectric models, even though the total electrostatic interaction free energies are within 11% of each other. PMID:25494774
DEFF Research Database (Denmark)
Jensen, Mogens Høgh; Lomdahl, P. S.
1982-01-01
with lower and higher charge than ±2e / 3. The effect of discreteness is taken into account and gives rise to chaotic deformed solitons as the interchain coupling increases. The model may be applied to tetrathiafulvalene tetracyanoquinodimethane (TTF-TCNQ) under 19-kbar pressure.......We have studied the effect of interchain interaction on thermally excited solitons in a charge-density wave for a Peierls system of commensurability 3. In such a system solitons with charges ±2e / 3 are expected. It is shown that the interchain coupling in some cases will generate solitons...
The structure of XLPE and the distribution of space charge
Institute of Scientific and Technical Information of China (English)
李吉晓; 张冶文; 郑飞虎; 吴长顺; 夏钟福
2003-01-01
The formation and accumulation of space charge under charge treatment are investigated using PWP method. The interaction between space charge and the structure of XLPE is measured using infrared spectroscopy (IR) method. The related mechanism about space charge distribution and the structure of XLPE are discussed.
Survival of charged rho condensation at high temperature and density
Liu, Hao; Huang, Mei
2015-01-01
The charged vector $\\rho$ mesons in the presence of external magnetic fields at finite temperature $T$ and chemical potential $\\mu$ have been investigated in the framework of the Nambu--Jona-Lasinio model. We compute the masses of charged $\\rho$ mesons numerically as a function of the magnetic field for different values of temperature and chemical potential. The self-energy of the $\\rho$ meson contains the quark-loop contribution, i.e. the leading order contribution in $1/N_c$ expansion. The charged $\\rho$ meson mass decreases with the magnetic field and drops to zero at a critical magnetic field $eB_c$, which means that the charged vector meson condensation, i.e. the electromagnetic superconductor can be induced above the critical magnetic field. Surprisingly, it is found that the charged $\\rho$ condensation can even survive at high temperature and density. At zero temperature, the critical magnetic field just increases slightly with the chemical potential, which indicates that the charged $\\rho$ condensatio...
Complexity Analysis of Peat Soil Density Distribution
Sampurno, Joko; Diah Faryuni, Irfana; Dzar Eljabbar Latief, Fourier; Srigutomo, Wahyu
2016-08-01
The distributions of peat soil density have been identified using fractal analysis method. The study was conducted on 5 peat soil samples taken from a ground field in Pontianak, West Kalimantan, at the coordinates (0 ° 4 '2:27 "S, 109 ° 18' 48.59" E). In this study, we used micro computerized tomography (pCT Scanner) at 9.41 micro meter per pixel resolution under peat soil samples to provide 2-D high-resolution images L1-L5 (200 200 pixels) that were used to detect the distribution of peat soil density. The method for determining the fractal dimension and intercept was the 2-D Fourier analysis method. The method was used to obtain the log log-plot of magnitude with frequency. Fractal dimension was obtained from the straight regression line that interpolated the points in the interval with the largest coefficient determination. Intercept defined by the point of intersection on the -axis. The conclusion was that the distributions of peat soil density showing the fractal behaviour with the heterogeneity of the samples from the highest to the lowest were L5, L1, L4, L3 and L2. Meanwhile, the range of density values of the samples from the highest to the lowest was L3, L2, L4, L5 and L1. The study also concluded that the behaviour of the distribution of peat soil density was a weakly anisotropic.
Geometric interpretation of density displacements and charge sensitivities
Indian Academy of Sciences (India)
Roman F Nalewajski
2005-09-01
The ``geometric” interpretation of the electronic density displacements in the Hilbert space is given and the associated projection-operator partitioning of the hardness and softness operators (kernels) is developed. The eigenvectors |á 〉 = \\{| 〉 \\} of the hardness operator define the complete (identity) projector $\\hat{P}$ = | 〉 〈 = 1 for general density displacements, including the charge-transfer (CT) component, while the eigenvectors | i 〉 = { | 〉} of the linear response operator determine the polarizational -projector, $\\hat{P}$ = | 〉 〈 |. Their difference thus defines the complementary CT-projector: $\\hat{P}$ = 1 - $\\hat{P}$. The complete vector space for density displacements can be also spanned by supplementing the -modes with the homogeneous CT-mode. These subspaces separate the integral (normalization) and local aspects of density shifts in molecular systems.
Fast electronic resistance switching involving hidden charge density wave states
Vaskivskyi, I.; Mihailovic, I. A.; Brazovskii, S.; Gospodaric, J.; Mertelj, T.; Svetin, D.; Sutar, P.; Mihailovic, D.
2016-05-01
The functionality of computer memory elements is currently based on multi-stability, driven either by locally manipulating the density of electrons in transistors or by switching magnetic or ferroelectric order. Another possibility is switching between metallic and insulating phases by the motion of ions, but their speed is limited by slow nucleation and inhomogeneous percolative growth. Here we demonstrate fast resistance switching in a charge density wave system caused by pulsed current injection. As a charge pulse travels through the material, it converts a commensurately ordered polaronic Mott insulating state in 1T-TaS2 to a metastable electronic state with textured domain walls, accompanied with a conversion of polarons to band states, and concurrent rapid switching from an insulator to a metal. The large resistance change, high switching speed (30 ps) and ultralow energy per bit opens the way to new concepts in non-volatile memory devices manipulating all-electronic states.
Scattered surface charge density: A tool for surface characterization
Naydenov, Borislav
2011-11-28
We demonstrate the use of nonlocal scanning tunneling spectroscopic measurements to characterize the local structure of adspecies in their states where they are significantly less perturbed by the probe, which is accomplished by mapping the amplitude and phase of the scattered surface charge density. As an example, we study single-H-atom adsorption on the n-type Si(100)-(4 × 2) surface, and demonstrate the existence of two different configurations that are distinguishable using the nonlocal approach and successfully corroborated by density functional theory. © 2011 American Physical Society.
X-ray spectrum of a pinned charge density wave
Rosso, Alberto; Giamarchi, Thierry
2004-01-01
We calculate the x-ray diffraction spectrum produced by a pinned charge density wave (CDW). The signature of the presence of a CDW consists of two satellite peaks, asymmetric as a consequence of disorder. The shape and the intensity of these peaks are determined in the case of a collective weak pinning using the variational method. We predict divergent asymmetric peaks, revealing the presence of a Bragg glass phase. We deal also with the long range Coulomb interactions, concluding that both p...
Odd parity charge density-wave scattering in cuprates
Seibold, G; Grilli, M.; Lorenzana, J.
2009-01-01
We investigate a model where superconducting electrons are coupled to a frequency dependent charge-density wave (CDW) order parameter Delta(w). Our approach can reconcile the simultaneous existence of low energy Bogoljubov quasiparticles and high energy electronic order as observed in scanning tunneling microscopy (STM) experiments. The theory accounts for the contrast reversal in the STM spectra between positive and negative bias observed above the pairing gap. An intrinsic relation between ...
Surface Phason-Polaritons in Charge Density Wave Films
Wonneberger, W.; Lamche, R.
1997-01-01
The coupled non-radiative excitations of the electromagnetic field and phasons in films with a quasi one-dimensional charge density wave (CDW) are evaluated for P--polarization and CDW conducting axis inside the film. The prominent features are two surface phason-polariton branches extending from the CDW pinning frequency to the frequency of the longitudinal optical phason. These surface phason-polariton states are confined to a finite band of longitudinal wave numbers. Besides surface polari...
Non-linear conductivity of charge-density-wave systems
Werner, C. R.; Eckern, U.
1997-01-01
We consider the problem of sliding motion of a charge-density-wave subject to static disorder within an elastic medium model. Starting with a field-theoretical formulation, which allows exact disorder averaging, we propose a self-consistent approximation scheme to obtain results beyond the standard large-velocity expansion. Explicit calculations are carried out in three spatial dimensions. For the conductivity, we find a strong-coupling regime at electrical fields just above the pinning thres...
Point charges optimally placed to represent the multipole expansion of charge distributions.
Directory of Open Access Journals (Sweden)
Ramu Anandakrishnan
Full Text Available We propose an approach for approximating electrostatic charge distributions with a small number of point charges to optimally represent the original charge distribution. By construction, the proposed optimal point charge approximation (OPCA retains many of the useful properties of point multipole expansion, including the same far-field asymptotic behavior of the approximate potential. A general framework for numerically computing OPCA, for any given number of approximating charges, is described. We then derive a 2-charge practical point charge approximation, PPCA, which approximates the 2-charge OPCA via closed form analytical expressions, and test the PPCA on a set of charge distributions relevant to biomolecular modeling. We measure the accuracy of the new approximations as the RMS error in the electrostatic potential relative to that produced by the original charge distribution, at a distance 2x the extent of the charge distribution--the mid-field. The error for the 2-charge PPCA is found to be on average 23% smaller than that of optimally placed point dipole approximation, and comparable to that of the point quadrupole approximation. The standard deviation in RMS error for the 2-charge PPCA is 53% lower than that of the optimal point dipole approximation, and comparable to that of the point quadrupole approximation. We also calculate the 3-charge OPCA for representing the gas phase quantum mechanical charge distribution of a water molecule. The electrostatic potential calculated by the 3-charge OPCA for water, in the mid-field (2.8 Å from the oxygen atom, is on average 33.3% more accurate than the potential due to the point multipole expansion up to the octupole order. Compared to a 3 point charge approximation in which the charges are placed on the atom centers, the 3-charge OPCA is seven times more accurate, by RMS error. The maximum error at the oxygen-Na distance (2.23 Å is half that of the point multipole expansion up to the octupole
Electric Vehicle (EV) Charging Management with Dynamic Distribution System Tariff
DEFF Research Database (Denmark)
O'Connell, Niamh; Wu, Qiuwei; Østergaard, Jacob;
2011-01-01
An electric vehicle (EV) charging schedule algorithm was proposed in this paper in order to charge EVs to meet EV users’ driving needs with the minimum EV charging cost and respect the local distribution system constraints. A day-ahead dynamic distribution system tariff scheme was proposed to avoid...... congestions in local distribution systems from the day-ahead planning perspective. Locational marginal pricing method was used to determine the dynamic distribution system tariff based on predicted day-ahead spot prices and predicted charging behaviors. Distribution grids of the Bornholm power system were...
Experimental charge density of hematite in its magnetic low temperature and high temperature phases
Energy Technology Data Exchange (ETDEWEB)
Theissmann, R., E-mail: ralf.theissmann@kronosww.com [Faculty of Engineering and CeNIDE (Center for NanoIntegration Duisburg-Essen), University of Duisburg-Essen, Bismarckstr. 81, 47057 Duisburg (Germany); Fuess, H. [Institute for Materials Science, Darmstadt University of Technology, Petersenstr. 23, 64287 Darmstadt (Germany); Tsuda, K. [Institute of Multidisciplinary Research for Advanced Materials, Tohoku University, 2-1-1 Katahira, 980-8577 Sendai (Japan)
2012-09-15
Structural parameters of hematite ({alpha}-Fe{sub 2}O{sub 3}), including the valence electron distribution, were investigated using convergent beam electron diffraction (CBED) in the canted antiferromagnetic phase at room temperature and in the collinear antiferromagnetic phase at 90 K. The refined charge density maps are interpreted as a direct result of electron-electron interaction in a correlated system. A negative deformation density was observed as a consequence of closed shell interaction. Positive deformation densities are interpreted as a shift of electron density to antibinding molecular orbitals. Following this interpretation, the collinear antiferromagnetic phase shows the characteristic of a Mott-Hubbard type insulator whereas the high temperature canted antiferromagnetic phase shows the characteristic of a charge transfer insulator. The break of the threefold symmetry in the canted antiferromagnetic phase was correlated to the presence of oxygen-oxygen bonding, which is caused by a shift of spin polarized charge density from iron 3d-orbitals to the oxygen ions. We propose a triangular magnetic coupling in the oxygen planes causing a frustrated triangular spin arrangement with all spins lying in the oxygen planes. This frustrated arrangement polarizes the super-exchange between iron ions and causes the spins located at the iron ions to orient in the same plane, perpendicular to the threefold axis. -- Highlights: Black-Right-Pointing-Pointer Quantitative CBED was used to study hematite ({alpha}-Fe2O3). Black-Right-Pointing-Pointer Structure and charge density of both antiferromagnetic phases were investigated. Black-Right-Pointing-Pointer Topological charge density analysis was combined with a Bader analysis. Black-Right-Pointing-Pointer A transition from a Mott-Hubbard to a charge transfer insulator is proposed. Black-Right-Pointing-Pointer A frustrated triangular magnetic coupling in the oxygen planes is proposed.
Kato, Shinichi; Harada, Hiroyuki; Hotchi, Hideaki; Okabe, Kota; Yamamoto, Kazami; Kinsho, Michikazu
For high intensity proton accelerators, one of the beam loss sources is the incoherent tune spread caused by the space charge force. In the 3 GeV rapid cycling synchrotron of the Japan Proton Accelerator Research Complex, beams are injected sequentially and shifted slightly from the central orbit in order to increase the beam size intentionally and suppress the charge density and incoherent tune spread. This injection method has been adopted and suppressed the beam loss. However, simulations clarified that beams did not spread as much as expected because of the space charge effect in the high current case. As simulation results of the optimized beam shift pattern when the space charge effect is considered, it was obtained that the incoherent tune spread could be suppressed to an extent that has not been achieved previously.
From super-charged nuclei to massive nuclear density cores
Popov, Vladimir
2010-01-01
Due to $e^+e^-$-pair production in the field of supercritical $(Z \\gg Z_{cr}\\approx 170 $) nucleus an electron shell, created out of the vacuum, is formed. The distribution of the vacuum charge in this shell has been determined for super-charged nuclei $Ze^3 \\ga 1$ within the framework of the Thomas-Fermi equation generalized to the relativistic case. For $Ze^3 \\gg 1$ the electron shell penetrates inside the nucleus and almost completely screens its charge. Inside such nucleus the potential takes a constant value equal to $V_0=-(3\\pi^2 n_p)^{1/3} \\sim -2m_{\\pi}c^2$, and super-charged nucleus represents an electrically neutral plasma consisting of $e,p$ and $n$. Near the edge of the nucleus a transition layer exists with a width $\\lambda \\approx \\alpha^{-1/2} \\hbar/m_{\\pi} c\\sim 15$ fm, which is independent of $Z~~ (\\hbar/m_{\\pi} c \\ll \\lambda \\ll \\hbar/m_e c)$. The electric field and surface charge are concentrated in this layer. These results, obtained earlier for hypothetical superheavy nuclei with $Z \\sim ...
Charge Distribution Dependency on Gap Thickness of CMS Endcap RPC
Park, Sung K; Lee, Kyongsei
2016-01-01
We report a systematic study of charge distribution dependency of CMS Resistive Plate Chamber (RPC) on gap thickness. Prototypes of double-gap RPCs with six different gap thickness ranging from from 1.0 to 2.0 mm in 0.2-mm steps have been built with 2-mm-thick phenolic high-pressure-laminated plates. The efficiencies of the six gaps are measured as a function of the effective high voltages. We report that the strength of the electric fields of the gap is decreased as the gap thickness is increased. The distributions of charges in six gaps are measured. The space charge effect is seen in the charge distribution at the higher voltages. The logistic function is used to fit the charge distribution data. Smaller charges can be produced within smaller gas gap. But the digitization threshold should be also lowered to utilize these smaller charges.
Statistical nuclear properties (level densities, spin distributions)
International Nuclear Information System (INIS)
A general overview is given on the phenomenological methods used to describe the level densities in nuclei. Two well-known two-parameter formulas of level densities, the Back-Shifted Fermi Gas (BSFG) model and the Constant Temperature (CT) model, were used. A common ingredient of both is the spin distribution function, which contains in Ericsons's parametrization the spin-cutoff parameter σ. A realistic description of the parameters of both spin distribution function and the two level density models has been obtained by fitting the experimental data of 310 nuclei between 18F and 251Cf, consisting of the complete level schemes at low excitation energies and the s-wave neutron resonance spacings at the neutron binding energy. We determine a simple formula for the spin-cutoff parameter as a function of mass number and excitation energy. Also, an even-odd spin staggering in the spin distribution of the even-even nuclei was observed, and described with a simple formula. Using this newly defined spin distribution function, an empirical set of parameters of the BSFG and CT models was determined by fitting both the low-energy levels and the neutron resonance spacings. For these parameters, simple formulas were proposed that involve only quantities available from the mass tables, and allow reasonable estimations of the level density parameters for nuclei far from stability. Both the BSFG and CT models describe equally well the level densities at energies up to at least the neutron binding energy. Finally, we discuss recent experimental evidence that the CT model is the more correct description of the nuclei in the low-excitation energy (pairing) regime.
Charge Order Induced in an Orbital Density-Wave State
Singh, Dheeraj Kumar; Takimoto, Tetsuya
2016-04-01
Motivated by recent angle resolved photoemission measurements [D. V. Evtushinsky et al., Phys. Rev. Lett. 105, 147201 (2010)] and evidence of the density-wave state for the charge and orbital ordering [J. García et al., Phys. Rev. Lett. 109, 107202 (2012)] in La0.5Sr1.5MnO4, the issue of charge and orbital ordering in a two-orbital tight-binding model for layered manganite near half doping is revisited. We find that the charge order with the ordering wavevector 2{Q} = (π ,π ) is induced by the orbital order of d-/d+-type having B1g representation with a different ordering wavevector Q, where the orbital order as the primary order results from the strong Fermi-surface nesting. It is shown that the induced charge order parameter develops according to TCO - T by decreasing the temperature below the orbital ordering temperature TCO, in addition to the usual mean-field behavior of the orbital order parameter. Moreover, the same orbital order is found to stabilize the CE-type spin arrangement observed experimentally below TCE < TCO.
Charge density waves in strongly correlated electron systems
Chen, Chih-Wei; Choe, Jesse; Morosan, E.
2016-08-01
Strong electron correlations are at the heart of many physical phenomena of current interest to the condensed matter community. Here we present a survey of the mechanisms underlying such correlations in charge density wave (CDW) systems, including the current theoretical understanding and experimental evidence for CDW transitions. The focus is on emergent phenomena that result as CDWs interact with other charge or spin states, such as magnetism and superconductivity. In addition to reviewing the CDW mechanisms in 1D, 2D, and 3D systems, we pay particular attention to the prevalence of this state in two particular classes of compounds, the high temperature superconductors (cuprates) and the layered transition metal dichalcogenides. The possibilities for quantum criticality resulting from the competition between magnetic fluctuations and electronic instabilities (CDW, unconventional superconductivity) are also discussed.
Charge density waves in strongly correlated electron systems.
Chen, Chih-Wei; Choe, Jesse; Morosan, E
2016-08-01
Strong electron correlations are at the heart of many physical phenomena of current interest to the condensed matter community. Here we present a survey of the mechanisms underlying such correlations in charge density wave (CDW) systems, including the current theoretical understanding and experimental evidence for CDW transitions. The focus is on emergent phenomena that result as CDWs interact with other charge or spin states, such as magnetism and superconductivity. In addition to reviewing the CDW mechanisms in 1D, 2D, and 3D systems, we pay particular attention to the prevalence of this state in two particular classes of compounds, the high temperature superconductors (cuprates) and the layered transition metal dichalcogenides. The possibilities for quantum criticality resulting from the competition between magnetic fluctuations and electronic instabilities (CDW, unconventional superconductivity) are also discussed. PMID:27376547
Charge-density waves physics revealed by photoconduction
Energy Technology Data Exchange (ETDEWEB)
Zaitsev-Zotov, S.V., E-mail: serzz@cplire.ru [Kotel' nikov Institute of Radio-engineering and Electronics of the RAS, 125009 Moscow (Russian Federation); Moscow Institute of Physics and Technology, 141700 Dolgoprudny (Russian Federation); Nasretdinova, V.F.; Minakova, V.E. [Kotel' nikov Institute of Radio-engineering and Electronics of the RAS, 125009 Moscow (Russian Federation)
2015-03-01
The results of photoconduction study of the Peierls conductors are reviewed. The studied materials are quasi-one-dimensional conductors with the charge-density wave: K{sub 0.3}MoO{sub 3}, both monoclinic and orthorhombic TaS{sub 3} and also a semiconducting phase of NbS{sub 3} (phase I). Experimental methods, relaxation times, effects of illumination on linear and nonlinear charge transport, the electric-field effect on photoconduction and results of the spectral studies are described. We demonstrate, in particular, that a simple model of modulated energy gap slightly smoothed by fluctuations fits the available spectral data fairly well. The level of the fluctuations is surprisingly small and does not exceed a few percent of the optical energy gap value.
Tensor Metrics and Charged Containers for 3D Q-space Sample Distribution
Knutsson, Hans; Westin, Carl-Fredrik
2013-01-01
This paper extends Jones’ popular electrostatic repulsion based algorithm for distribution of single-shell Q-space samples in two fundamental ways. The first alleviates the single-shell requirement enabling full Q-space sampling. Such an extension is not immediately obvious since it requires distributing samples evenly in 3 dimensions. The extension is as elegant as it is simple: Add a container volume of the desired shape having a constant charge density and a total charge equal to the negat...
Photoemission spectra of charge density wave states in cuprates
Tu, Wei-Lin; Chen, Peng-Jen; Lee, Ting-Kuo
Angle-resolved photoemission spectroscopy(ARPES) experiments have reported many exotic properties of cuprates, such as Fermi arc at normal state, two gaps at superconducting state and particle-hole asymmetry at the antinodal direction. On the other hand, a number of inhomogeneous states or so-called charge density waves(CDW) states have also been discovered in cuprates by many experimental groups. The relation between these CDW states and ARPES spectra is unclear. With the help of Gutzwiller projected mean-field theory, we can reproduce the quasiparticle spectra in momentum space. The spectra show strong correspondence to the experimental data with afore-mentioned exotic features in it.
Ghasemi, S. Alireza; Hofstetter, Albert; Saha, Santanu; Goedecker, Stefan
2015-07-01
Based on an analysis of the short-range chemical environment of each atom in a system, standard machine-learning-based approaches to the construction of interatomic potentials aim at determining directly the central quantity, which is the total energy. This prevents, for instance, an accurate description of the energetics of systems in which long-range charge transfer or ionization is important. We propose therefore not to target directly with machine-learning methods the total energy but an intermediate physical quantity, namely, the charge density, which then in turn allows us to determine the total energy. By allowing the electronic charge to distribute itself in an optimal way over the system, we can describe not only neutral but also ionized systems with unprecedented accuracy. We demonstrate the power of our approach for both neutral and ionized NaCl clusters where charge redistribution plays a decisive role for the energetics. We are able to obtain chemical accuracy, i.e., errors of less than a millihartree per atom compared to the reference density functional results for a huge data set of configurations with large structural variety. The introduction of physically motivated quantities which are determined by the short-range atomic environment via a neural network also leads to an increased stability of the machine-learning process and transferability of the potential.
Shells of charge: a density functional theory for charged hard spheres
Roth, Roland; Gillespie, Dirk
2016-06-01
A functional for the electrostatic excess free-energy for charged, hard sphere fluids is proposed. The functional is derived from two complementary, but equivalent, interpretations of the mean spherical approximation (MSA). The first combines fundamental measure theory (FMT) from hard-core interactions with the idea that MSA can be interpreted in terms of the interaction spherical shells of charge. This formulation gives the free-energy density as a function of weighted densities. When all the ions have the same size, the functional adopts an FMT-like form. The second in effect ‘functionalizes’ the derivation of MSA; that is, it generalizes the MSA as a functional-based version of MSA (fMSA). This formulation defines the free-energy density as a function of a position-dependent MSA screening parameter and the weighted densities of the FMT approach. This FMT/fMSA functional is shown to give accurate density profiles, as compared to Monte Carlo simulations, under a wide range of ion concentrations, size asymmetries, and valences.
Charge carrier density in Li-intercalated graphene
Kaloni, Thaneshwor P.
2012-05-01
The electronic structures of bulk C 6Li, Li-intercalated free-standing bilayer graphene, and Li-intercalated bilayer and trilayer graphene on SiC(0 0 0 1) are studied using density functional theory. Our estimate of Young\\'s modulus suggests that Li-intercalation increases the intrinsic stiffness. For decreasing Li-C interaction, the Dirac point shifts to the Fermi level and the associated band splitting vanishes. For Li-intercalated bilayer graphene on SiC(0 0 0 1) the splitting at the Dirac point is tiny. It is also very small at the two Dirac points of Li-intercalated trilayer graphene on SiC(0 0 0 1). For all the systems under study, a large enhancement of the charge carrier density is achieved by Li intercalation. © 2012 Elsevier B.V. All rights reserved.
Distance distributions of photogenerated charge pairs in organic photovoltaic cells.
Barker, Alex J; Chen, Kai; Hodgkiss, Justin M
2014-08-27
Strong Coulomb interactions in organic photovoltaic cells dictate that charges must separate over relatively long distances in order to circumvent geminate recombination and produce photocurrent. In this article, we measure the distance distributions of thermalized charge pairs by accessing a regime at low temperature where charge pairs are frozen out following the primary charge separation step and recombine monomolecularly via tunneling. The exponential attenuation of tunneling rate with distance provides a sensitive probe of the distance distribution of primary charge pairs, reminiscent of electron transfer studies in proteins. By fitting recombination dynamics to distributions of recombination rates, we identified populations of charge-transfer states and well-separated charge pairs. For the wide range of materials we studied, the yield of separated charges in the tunneling regime is strongly correlated with the yield of free charges measured via their intensity-dependent bimolecular recombination dynamics at room temperature. We therefore conclude that populations of free charges are established via long-range charge separation within the thermalization time scale, thus invoking early branching between free and bound charges across an energetic barrier. Subject to assumed values of the electron tunneling attenuation constant, we estimate critical charge separation distances of ∼3-4 nm in all materials. In some blends, large fullerene crystals can enhance charge separation yields; however, the important role of the polymers is also highlighted in blends that achieved significant charge separation with minimal fullerene concentration. We expect that our approach of isolating the intrinsic properties of primary charge pairs will be of considerable value in guiding new material development and testing the validity of proposed mechanisms for long-range charge separation.
Charge-State Distributions of Accelerated ^{48}Ca Ions
Skobelev, N K; Astabatyan, R A; Vincour, J; Kulko, A A; Lobastov, S P; Lukyanov, S M; Markaryan, E R; Maslov, V A; Penionzhkevich, Yu E; Sobolev, Yu G; Ugryumov, V Yu
2003-01-01
A stepped pole broad-range magnetic analyzer has been used to measure the charge-state distributions of accelerated ^{48}Ca ions at the two incident energies 242.8 and 264.5 MeV after passing through thin carbon or gold target foils. The measured charge-state distributions and the mean equilibrium charge of the ^{48}Ca ions are compared with various calculations. It has been shown that the calculations can be used only for evaluation purposes.
Bardakçı, Tayyibe; Kumru, Mustafa; Altun, Ahmet
2016-07-01
The Cu(II), Zn(II), Cd(II), and Hg(II) bromide complexes of p-toluidine have been studied with B3LYP calculations by using def2-TZVP basis set at the metal atoms and using def2-TZVP and 6-311G+(d,p) basis sets at the remaining atoms. Both basis set combinations give analogous results, which validate the use of quickly converging 6-311G+(d,p) basis set in future studies. The molecular structures, atomic charge and spin distributions, and harmonic vibrational frequencies of the complexes have been calculated. The Zn, Cd and Hg complexes have been found to have distorted tetrahedral environments around the metal atoms whereas Cu complex has a square planar geometry. The NBO charge analysis have been found more accurate and less misleading compared with the Mulliken scheme. The present vibrational spectra calculations allow accurate assignment of the vibrational bands, which otherwise assigned tentatively in previous experimental-only studies.
Boson ground state fields in electroweak theory with non-zero charge densities
Syska, J.
2002-01-01
The "non-linear" self-consistent theory of classical fields in the electroweak model is proposed. Homogeneous boson ground state solutions in the GSW model at the presence of a non-zero extended fermionic charge densities are reviewed and fully reinterpreted to make the theory with non-zero charge densities fruitful. Consequences of charge density fluctuations are proposed.
The influence of oxidation on space charge formation in gamma-irradiated low-density polyethylene
Chen, G; Xie, H K; Banford, H M; Davies, A E
2003-01-01
The research presented in this paper investigates the role of oxidation in the formation of space charge in gamma-irradiated low-density polyethylene after being electrically stressed under dc voltage. Polyethylene plaques both with and without antioxidant were irradiated up to 500 kGy using a sup 6 sup 0 Co gamma source and space charge distributions were measured using the piezoelectric induced pressure wave propagation method. It has been found that a large amount of positive charge evolved adjacent to the cathode in the sample without antioxidant and was clearly associated with oxidation of the surface. The amount of charge formed for a given applied stress increased with the dose absorbed by the material. A model has been proposed to explain the formation of space charge and its profile. The charge decay after the removal of the external applied stress is dominated by a process being controlled by the cathode interfacial stress (charge injection) rather than a conventional RC circuit model. On the other ...
Matveev, Oleg; Shvaika, Andrij; Devereaux, Thomas; Freericks, James
The charge-density-wave phase of the Falicov-Kimball model displays a number of anomalous behavior including the appearance of subgap density of states as the temperature increases. These subgap states should have a significant impact on transport properties, particularly the nonlinear response of the system to a large dc electric field. Using the Kadanoff-Baym-Keldysh formalism, we employ nonequilibrium dynamical mean-field theory to exactly solve for this nonlinear response. We examine both the current and the order parameter of the conduction electrons as the ordered system is driven by a dc electric field. Institute for Condensed Matter Physics of the National Academy of Sciences of Ukraine, Lviv, Ukraine.
Moon, Jong Kyun; Song, Myung Won; Pak, Hyuk Kyu
2015-05-01
A solid surface in contact with water or aqueous solution usually carries specific electric charges. These surface charges attract counter ions from the liquid side. Since the geometry of opposite charge distribution parallel to the solid-liquid interface is similar to that of a capacitor, it is called an electrical double layer capacitor (EDLC). Therefore, there is an electrical potential difference across an EDLC in equilibrium. When a liquid bridge is formed between two conducting plates, the system behaves as two serially connected EDLCs. In this work, we propose a new method for investigating the surface charge density on solid-liquid interfaces. By mechanically modulating the electrical double layers and simultaneously applying a dc bias voltage across the plates, an ac electric current can be generated. By measuring the voltage drop across a load resistor as a function of bias voltage, we can study the surface charge density on solid-liquid interfaces. Our experimental results agree very well with the simple equivalent electrical circuit model proposed here. Furthermore, using this method, one can determine the polarity of the adsorbed state on the solid surface depending on the material used. We expect this method to aid in the study of electrical phenomena on solid-liquid interfaces.
Moon, Jong Kyun; Song, Myung Won; Pak, Hyuk Kyu
2015-05-20
A solid surface in contact with water or aqueous solution usually carries specific electric charges. These surface charges attract counter ions from the liquid side. Since the geometry of opposite charge distribution parallel to the solid-liquid interface is similar to that of a capacitor, it is called an electrical double layer capacitor (EDLC). Therefore, there is an electrical potential difference across an EDLC in equilibrium. When a liquid bridge is formed between two conducting plates, the system behaves as two serially connected EDLCs. In this work, we propose a new method for investigating the surface charge density on solid-liquid interfaces. By mechanically modulating the electrical double layers and simultaneously applying a dc bias voltage across the plates, an ac electric current can be generated. By measuring the voltage drop across a load resistor as a function of bias voltage, we can study the surface charge density on solid-liquid interfaces. Our experimental results agree very well with the simple equivalent electrical circuit model proposed here. Furthermore, using this method, one can determine the polarity of the adsorbed state on the solid surface depending on the material used. We expect this method to aid in the study of electrical phenomena on solid-liquid interfaces.
Spatially Modulated Instabilities for Scaling Solutions at Finite Charge Density
Cremonini, Sera
2013-01-01
We consider finite charge density geometries which interpolate between AdS2 x R2 in the infrared and AdS4 in the ultraviolet, while traversing an intermediate regime of anisotropic Lifshitz scaling and hyperscaling violation. We work with Einstein-Maxwell-dilaton models and only turn on a background electric field. The spatially modulated instabilities of the near-horizon AdS2 part of the geometry are used to argue that the scaling solutions themselves should be thought of as being unstable -- in the deep infrared -- to spatially modulated phases. We identify instability windows for the scaling exponents, which are refined further by requiring the solutions to satisfy the null energy condition. This analysis reinforces the idea that, for large classes of models, spatially modulated phases describe the ground state of hyperscaling violating scaling geometries.
Charge density study of two FeS2 polymorphs
DEFF Research Database (Denmark)
Schmøkel, Mette Stokkebro; Jørgensen, Mads Ry Vogel; Bjerg, Lasse;
and theory is found. References [1] P. Coppens, Synchrotron Radiation in Crystallography, Academic Press: New York, 1992. [2] E.D. Stevens, M.L. DeLucia, P. Coppens, Inorg. Chem. 19 (1980) 813-820. [3] G.V. Gibbs, D.F. Cox, K.M. Rosso, N.L. Ross, R.T. Downs, M.A. Spackman, J. Phys. Chem. B. 111 (2007) 1923......Experimental charge density studies of inorganic solids have proven to be a difficult task due to systematic errors related to data collection such as absorption and extinction; however, the use of synchrotron radiation has the potential to minimize these problems. [1] One of the pioneering...
Thermodynamics of superconductors with charge-density waves
Gabovich, A M; Szymczak, H; Voitenko, A I
2003-01-01
Equations for the temperature-(T-) dependent superconducting (DELTA(T)) and dielectric (SIGMA(T)) order parameters are solved self-consistently in the partial dielectric gapping model of Bilbro and McMillan for superconductors with charge-density waves (CDWs). It is shown that for the close enough structural phase transition temperature, T sub s , and superconducting one, T sub c , with T sub s > T sub c , SIGMA below T sub c may become smaller than DELTA. The electronic heat capacity C(T) is calculated. It is shown that the discontinuity DELTA C at T = T sub c is always smaller than the Bardeen-Cooper-Schrieffer value. The effect is detectable over a wide range of the model parameters. Experimental implications for CDW superconductors, such as A15 compounds, high-T sub c cuprates, and MgB sub 2 , are suggested and discussed.
Energy Technology Data Exchange (ETDEWEB)
Balsa Terzic, Gabriele Bassi
2011-07-01
In this paper we discuss representations of charge particle densities in particle-in-cell (PIC) simulations, analyze the sources and profiles of the intrinsic numerical noise, and present efficient methods for their removal. We devise two alternative estimation methods for charged particle distribution which represent significant improvement over the Monte Carlo cosine expansion used in the 2d code of Bassi, designed to simulate coherent synchrotron radiation (CSR) in charged particle beams. The improvement is achieved by employing an alternative beam density estimation to the Monte Carlo cosine expansion. The representation is first binned onto a finite grid, after which two grid-based methods are employed to approximate particle distributions: (i) truncated fast cosine transform (TFCT); and (ii) thresholded wavelet transform (TWT). We demonstrate that these alternative methods represent a staggering upgrade over the original Monte Carlo cosine expansion in terms of efficiency, while the TWT approximation also provides an appreciable improvement in accuracy. The improvement in accuracy comes from a judicious removal of the numerical noise enabled by the wavelet formulation. The TWT method is then integrated into Bassi's CSR code, and benchmarked against the original version. We show that the new density estimation method provides a superior performance in terms of efficiency and spatial resolution, thus enabling high-fidelity simulations of CSR effects, including microbunching instability.
Breathing charge density waves in intrinsic Josephson junctions
Shukrinov, Yu. M.; Abdelhafiz, H.
2014-01-01
We demonstrate the creation of a charge density wave (CDW) along a stack of coupled Josephson junctions (JJs) in layered superconductors. Electric charge in each superconducting layer oscillates around some average value, forming a breathing CDW. We show the transformation of a longitudinal plasma wave to CDW in the state corresponding to the outermost branch. Transition between different types of CDW's related to the inner branches of IV characteristic is demonstrated. The effect of the external electromagnetic radiation on the states corresponding to the inner branches differs crucially from the case of the single JJ. The Shapiro steps in the IV characteristics of the junctions in the stack do not correspond directly to the frequency of radiation ω. The system of JJs behaves like a single whole system: the Shapiro steps or their harmonics in the total IV characteristics appear at voltage , where V l is the voltage in the lth junction, N R is the number of JJs in the rotating state, and m and n are integers.
High-energy Electron Scattering and the Charge Distributions of Selected Nuclei
Hahn, B.; Ravenhall, D. G.; Hofstadter, R.
1955-10-01
Experimental results are presented of electron scattering by Ca, V, Co, In, Sb, Hf, Ta, W, Au, Bi, Th, and U, at 183 Mev and (for some of the elements) at 153 Mev. For those nuclei for which asphericity and inelastic scattering are absent or unimportant, i.e., Ca, V, Co, In, Sb, Au, and Bi, a partial wave analysis of the Dirac equation has been performed in which the nuclei are represented by static, spherically symmetric charge distributions. Smoothed uniform charge distributions have been assumed; these are characterized by a constant charge density in the central region of the nucleus, with a smoothed-our surface. Essentially two parameters can be determined, related to the radium and to the surface thickness. An examination of the Au experiments show that the functional forms of the surface are not important, and that the charge density in the central regions is probably fairly flat, although it cannot be determined very accurately.
Type A Distributions: Infinitely Divisible Distributions Related to Arcsine Density
Maejima, Makoto; Sato, Ken-iti
2010-01-01
Two transformations $\\mathcal{A}_{1}$ and $\\mathcal{A}_{2}$ of L\\'{e}vy measures on $\\mathbb{R}^{d}$ based on the arcsine density are studied and their relation to general Upsilon transformations is considered. The domains of definition of $\\mathcal{A}_{1}$ and $\\mathcal{A}_{2}$ are determined and it is shown that they have the same range. Infinitely divisible distributions on $\\mathbb{R}^{d}$ with L\\'{e}vy measures being in the common range are called type $A$ distributions and expressed as the law of a stochastic integral $\\int_0^1\\cos (2^{-1}\\pi t)dX_t$ with respect to L\\'{e}vy process $\\{X_t\\}$. \\ This new class includes as a proper subclass the Jurek class of distributions. It is shown that generalized type $G$ distributions are the image of type $A$ distributions under a mapping defined by an appropriate stochastic integral. $\\mathcal{A}_{2}$ is identified as an Upsilon transformation, while $\\mathcal{A}_{1}$ is shown to be not.
The influence of nonthermal electron distributions on the charge state of heavy ions
Kartavykh, Yu.; Ostryakov, V.
2001-08-01
We investigate the influence of non-thermal electrons on the formation of ionic states of heavy elements in SEP events. The equilibrium mean charge of Mg, Si and Fe for several samples of non-Maxwellian populations (power law electron beam and bi-Maxwellian distribution) were calculated. According to our estimates the anomalously high density of non-thermal electrons is required to obtain substantial difference in the mean charge of heavy ions as compared with `pure' thermal dstribution.
Naik, Hemantkumar G; Yeniad, Bahar; Koning, Cor E; Heise, Andreas
2012-07-01
In an effort to study the effect of substituent groups of the substrate on the alcohol dehydrogenase (ADH) reductions of aryl-alkyl ketones, several derivatives of acetophenone have been evaluated against ADHs from Lactobacillus brevis (LB) and Thermoanaerobacter sp. (T). Interestingly, ketones with non-demanding (neutral) para-substituents were reduced to secondary alcohols by these enzymes in enantiomerically pure form whereas those with demanding (ionizable) substituents could not be reduced. The effect of substrate size, their solubility in the reaction medium, electron donating and withdrawing properties of the ligand and also the electronic charge density distribution on the substrate molecules have been studied and discussed in detail. From the results, it is observed that the electronic charge distribution in the substrate molecules is influencing the orientation of the substrate in the active site of the enzyme and hence the ability to reduce the substrate.
Charged fluid distribution in higher dimensional spheroidal space-time
Indian Academy of Sciences (India)
G P Singh; S Kotambkar
2005-07-01
A general solution of Einstein field equations corresponding to a charged fluid distribution on the background of higher dimensional spheroidal space-time is obtained. The solution generates several known solutions for superdense star having spheroidal space-time geometry.
The Calculation of the Electrostatic Potential of Infinite Charge Distributions
Redzic, Dragan V.
2012-01-01
We discuss some interesting aspects in the calculation of the electrostatic potential of charge distributions extending to infinity. The presentation is suitable for the advanced undergraduate level. (Contains 3 footnotes.)
Lee, Louis P; Limas, Nidia Gabaldon; Cole, Daniel J; Payne, Mike C; Skylaris, Chris-Kriton; Manz, Thomas A
2014-12-01
The density derived electrostatic and chemical (DDEC/c3) method is implemented into the onetep program to compute net atomic charges (NACs), as well as higher-order atomic multipole moments, of molecules, dense solids, nanoclusters, liquids, and biomolecules using linear-scaling density functional theory (DFT) in a distributed memory parallel computing environment. For a >1000 atom model of the oxygenated myoglobin protein, the DDEC/c3 net charge of the adsorbed oxygen molecule is approximately -1e (in agreement with the Weiss model) using a dynamical mean field theory treatment of the iron atom, but much smaller in magnitude when using the generalized gradient approximation. For GaAs semiconducting nanorods, the system dipole moment using the DDEC/c3 NACs is about 5% higher in magnitude than the dipole computed directly from the quantum mechanical electron density distribution, and the DDEC/c3 NACs reproduce the electrostatic potential to within approximately 0.1 V on the nanorod's solvent-accessible surface. As examples of conducting materials, we study (i) a 55-atom Pt cluster with an adsorbed CO molecule and (ii) the dense solids Mo2C and Pd3V. Our results for solid Mo2C and Pd3V confirm the necessity of a constraint enforcing exponentially decaying electron density in the tails of buried atoms.
Charge state distributions of iron in impulsive solar flares: Importance of stripping effects
Ostryakov, V. M.; Kartavykh, Y. Y.; Ruffolo, D.; Kovaltsov, G. A.; Kocharov, L.
2000-12-01
A model of stochastic acceleration of heavy ions by Alfvén wave turbulence has been developed. It takes into account spatial diffusion, Coulomb losses, and the possibility of charge changes for ions during stochastic acceleration. The main processes influencing the ionic charge states are the stripping by thermal electrons and protons as constituents of a surrounding medium and dielectronic and radiative recombination. We have calculated energy spectra and charge distributions of nonthermal Fe ions as a sample species. The dependence of the charge distributions and energy spectra of iron on the parameters of the plasma (temperature and number density) is studied. We compare our results with measurements to date of the mean charge of iron in impulsive solar flare events and conclude that they indicate source plasma ionization temperatures between 6□×106 and 107K.
Charge and longitudinal momentum distributions in transverse coordinate space
Mondal, Chandan; Dahiya, Harleen; Chakrabarti, Dipankar
2016-01-01
We investigate the charge distributions for the $u$ and $d$ quarks in transverse coordinate space in a light-front quark-diquark model for the nucleons using the overlaps of the wave functions constructed from the soft-wall AdS/QCD prediction. We have also obtained the charge distributions for proton and neutron in transverse coordinate space and compared it with the distributions obtained in impact-parameter space. Further, we study the longitudinal momentum distributions using the wave functions in the transverse coordinate space. We have also shown the explicit fermionic and bosonic contributions for different struck $u$ and $d$ quarks.
Mass and charge distribution in heavy-ion collisions
International Nuclear Information System (INIS)
A statistical model based on the independent particle picture is used to calculate mass and charge distributions in deep inelastic heavy-ion collisions. Different assumptions on volume and charge equilibrations are compared with measured variances of charge distributions. One combination of assumptions is clearly favoured by experiment, and gives a reasonable description of the variance versus energy loss curves up to energy losses of about 200 MeV in the heavy systems Kr+Ho and Xe+Bi, and up to about 60 MeV for the light system Ar+Ca
Pulsed electro-acoustic (PEA) measurements of embedded charge distributions
Dennison, J. R.; Pearson, Lee H.
2013-09-01
Knowledge of the spatial distribution and evolution of embedded charge in thin dielectric materials has important applications in semiconductor, high-power electronic device, high-voltage DC power cable insulation, high-energy and plasma physics apparatus, and spacecraft industries. Knowing how, where, and how much charge accumulates and how it redistributes and dissipates can predict destructive charging effects. Pulsed Electro-acoustic (PEA) measurements— and two closely related methods, Pressure Wave Propagation (PWP) and Laser Intensity Modulation (LIMM)— nondestructively probe such internal charge distributions. We review the instrumentation, methods, theory and signal processing of simple PEA experiments, as well as the related PPW and LIMM methods. We emphasize system improvements required to achieve high spatial resolution for in vacuo measurements of thin dielectrics charged using electron beam injection.
Multiplicity distributions and charged-neutral ﬂuctuations
Indian Academy of Sciences (India)
Tapan K Nayak; M M Aggarwal; A Agnihotri; Z Ahammed; A L S Angelis; V Antonenko; V Arefiev; V Astakhov; V Avdeitchikov; T C Awes; P V K S Baba; S K Badyal; A Baldine; L Barabach; C Barlag; S Bathe; B Tatiounia; T Bernier; K B Bhalla; V S Bhatia; C Blume; R Bock; E-M Bohne; D Bucher; A Buijs; E-J Buis; H Büsching; L Carlen; V Chalyshev; S Chattopadhyay; K E Chenawi; R Cherbatchev; T Chujo; A Claussen; A C Das; M P Decowski; V Djordjadze; P Donni; I Doubovik; A K Dubey; M R Dutta Majumdar; S Eliseev; K Enosawa; H Feldmann; P Foka; S Fokin; V Frolov; M S Ganti; S Garpman; O Gavrishchuk; F J M Geurts; T K Ghosh; R Glasow; S K Gupta; B Guskov; H A Gustafsson; H H Gutbrod; R Higuchi; I Hrivnacova; M Ippolitov; H Kalechofsky; R Kamermans; K-H Kampert; K Karadjev; K Karpio; S Kato; S Kees; H Kim; B W Kolb; I Kosarev; I Koutcheryaev; A Kugler; P Kulinich; V Kumar; M Kurata; K Kurita; K Kuzmin; I Langbein; A Lebedev; Y Y Lee; H Löhner; D P Mahapatra; V Manko; M Martin; A Maximov; R Mehdiyev; G Mgebrichvili; Y Miake; D Mikhalev; G C Mishra; Y Miyamoto; B Mohanty; D Morrison; D S Mukhopadhyay; V Myalkovski; H Naef; B K Nandi; S K Nayak; T K Nayak; S Neumaier; A Nianine; V Nikitine; S Nikolaev; S Nishimura; P Nomokov; J Nystrand; F E Obenshain; A Oskarsson; I Otterlund; M Pachr; A Parfenov; S Pavliouk; T Peitzmann; V Petracek; F Plasil; M L Purschke; B Raeven; J Rak; R Raniwala; S Raniwala; V S Ramamurthy; N K Rao; F Retiere; K Reygers; G Roland; L Rosselet; I Roufanov; J M Rubio; S S Sambyal; R Santo; S Sato; H Schlagheck; H-R Schmidt; G Shabratova; I Sibiriak; T Siemiarczuk; B C Sinha; N Slavine; K Söderström; N Solomey; G Sood; S P Sørensen; P Stankus; G Stefanek; P Steinberg; E Stenlund; D Stüken; M Sumbera; T Svensson; M D Trivedi; A Tsvetkov; C Twenhöfel; L Tykarski; J Urbahn; N V Eijndhoven; W H V Heeringen; G J V Nieuwenhuizen; A Vinogradov; Y P Viyogi; A Vodopianov; S Vörös; M A Vos; B Wyslouch; K Yogi; Y Yokota; G R Young
2001-08-01
Results from the multiplicity distributions of inclusive photons and charged particles, scaling of particle multiplicities, event-by-event multiplicity ﬂuctuations, and charged-neutral ﬂuctuations in 158 GeV Pb+Pb collisions are presented and discussed. A scaling of charged particle multiplicity as $N^{1.07± 0:05}_{\\text{part}}$ and photons as $N^{1.12± 0:03}_{\\text{part}}$ have been observed, indicating violation of naive wounded nucleon model. The analysis of localized charged-neutral ﬂuctuation indicates a model-independent demonstration of non-statistical ﬂuctuations in both charged particles and photons in limited azimuthal regions. However, no correlated charged-neutral ﬂuctuations are observed.
Plane density of induced vacuum charge in a supercritical Coulomb potential
Khalilov, V R
2016-01-01
An expression for the density of a planar induced vacuum charge is obtained in a strong Coulomb potential in coordinate space. Treatment is based on a self-adjoint extension approach for constructing of the Green's function of a charged fermion in this potential. Induced vacuum charge density is calculated and analyzed at the subcritical and supercritical Coulomb potentials for massless and massive fermions. The behavior of the obtained vacuum charge density is investigated at long and short distances from the Coulomb center. The induced vacuum charge has a screening sign. Screening of a Coulomb impurity in graphene is briefly discussed. We calculate the real vacuum polarization charge density that acquires the quantum electrodynamics vacuum in the supercritical Coulomb potential due to the so-called real vacuum polarization. It is shown that the vacuum charge densities essentially differ in massive and massless cases. We expect that our results can, as a matter of principle, be tested in graphene with a supe...
Langevin description of fission fragment charge distribution from excited nuclei
Karpov, A V
2002-01-01
A stochastic approach to fission dynamics based on a set of three-dimensional Langevin equations was applied to calculate fission-fragment charge distribution of compound nucleus sup 2 sup 3 sup 6 U. The following collective coordinates have been chosen - elongation coordinate, neck-thickness coordinate, and charge-asymmetry coordinate. The friction coefficient of charge mode has been calculated in the framework of one-body and two-body dissipation mechanisms. Analysis of the results has shown that Langevin approach is appropriate for investigation of isobaric distribution. Moreover, the dependences of the variance of the charge distribution on excitation energy and on the two-body viscosity coefficient has been studied
Surface valence charge distributions and scanning tunneling microscopy of WTe 2
Tang, S. L.; Kasowski, R. V.; Suna, A.; Parkinson, B. A.
1990-11-01
We have studied the surface electronic structures of the van der Waals surfaces of tungsten ditelluride (WTe 2) with first principles calculations of the spatial distribution of the surface valence charge densities and compared the results to images obtained with the scanning tunneling microscope (STM). The energy- and z(distance from the surface)-dependent calculations show that the valence charge density distribution above the Te surface could be derived from the surface Te layer, as we previously calculated, but the charge density distribution close to but below the Fermi energy has a distortion that coincidentally makes it appear to have a symmetry close to the paired, zig-zag and buckled rows of the W layer. These results dramatically illustrate that in highly covalent compounds, the surface valence charge density distribution does not necessarily follow the surface atomic positions even on ideal, unreconstructed surfaces. An alternative interpretation of the STM images of this surface is proposed in light of this new surface electronic structure. Our calculated and experimental results are also discussed with reference to recent STM results on other transition metal dichalcogenides.
Directory of Open Access Journals (Sweden)
M. V. Rodrigues
2006-03-01
Full Text Available This work gives sequence to the study on the measurement of the electrostatic charges in aerosols. The particle charge classifier developed for this purpose and presented in the previous paper (Marra and Coury, 2000 has been used here to measure the particle charge distribution of a number of different aerosols. The charges acquired by the particles were naturally derived from the aerosol generation procedure itself. Two types of aerosol generators were used: the vibrating orifice generator and turntable Venturi plate generator. In the vibrating orifice generator, mono-dispersed particles were generated by a solution of water/ethanol/methylene blue, while in the rotating plate generator, six different materials were utilized. The results showed no clear dependence between electric charge and particle diameter for the mono-dispersed aerosol. However, for the poly-dispersed aerosols, a linear dependence between particle size and charge could be noticed.
Heavy ion charge-state distribution effects on energy loss in plasmas
Barriga-Carrasco, Manuel D.
2013-10-01
According to dielectric formalism, the energy loss of the heavy ion depends on its velocity and its charge density. Also, it depends on the target through its dielectric function; here the random phase approximation is used because it correctly describes fully ionized plasmas at any degeneracy. On the other hand, the Brandt-Kitagawa (BK) model is employed to depict the projectile charge space distribution, and the stripping criterion of Kreussler is used to determine its mean charge state . This latter criterion implies that the mean charge state depends on the electron density and temperature of the plasma. Also, the initial charge state of the heavy ion is crucial for calculating inside the plasma. Comparing our models and estimations with experimental data, a very good agreement is found. It is noticed that the energy loss in plasmas is higher than that in the same cold gas cases, confirming the well-known enhanced plasma stopping (EPS). In this case, EPS is only due to the increase in projectile effective charge Qeff, which is obtained as the ratio between the energy loss of each heavy ion and that of the proton in the same plasma conditions. The ratio between the effective charges in plasmas and in cold gases is higher than 1, but it is not as high as thought in the past. Finally, another significant issue is that the calculated effective charge in plasmas Qeff is greater than the mean charge state , which is due to the incorporation of the BK charge distribution. When estimations are performed without this distribution, they do not fit well with experimental data.
Charged-particle rapidity density in Au+Au collisions in a quark combination model
Shao, Feng-Lan; Yao, Tao; Xie, Qu-Bing
2007-03-01
Rapidity/pseudorapidity densities for charged particles and their centrality, rapidity, and energy dependence in Au+Au collisions at the Relativistic Heavy Ion Collider are studied in a quark combination model. Using a Gaussian-type rapidity distribution for constituent quarks as a result of Landau hydrodynamic evolution, the data at sNN=130,200 GeV at various centralities in full pseudorapidity range are well described, and the charged-particle multiplicities are reproduced as functions of the number of participants. The energy dependence of the shape of the dNch/dη distribution is also described at various collision energies sNN=200,130,62.4 GeV in central collisions with same value of parameters except 19.6 GeV. The calculated rapidity distributions and yields for the charged pions and kaons in central Au+Au collisions at sNN=200 GeV are compared with experimental data of the BRAHMS Collaboration.
Density Dependence of Charge-4 Vortex Splitting in Bose–Einstein Condensates
Shibayama, Hitoshi; Tsukada, Akinori; Yoshihara, Takahisa; Kuwamoto, Takeshi
2016-05-01
We studied the axial-direction density dependence of the splitting of a charge-4 vortex created in 87Rb Bose–Einstein condensates. Vortices were generated by topological phase imprinting, and the axial density of the condensates was controlled by an optical potential. Linear and triangular arrangements of four single-charged vortices that emerged through the charge-4 vortex collapse were observed. The splitting of the charge-4 vortices was suppressed by maintaining the density outside the l = 2 unstable mode regions where linear arrangements were formed. In addition, we studied vortex dynamics in a high density region for which investigations have not been previously performed.
Chemical Bonding and Charge Distribution at Metallic Nanocontacts
Schwingenschloegl, Udo; Schuster, Cosima
2006-01-01
We present results of electronic structure calculations for aluminium contacts of atomic size, based on density functional theory and the local density approximation. Addressing the atomic orbitals at the neck of the nanocontact, we find that the local band structure deviates strongly from bulk fcc aluminium. In particular, hybridization between Al 3s and 3p states is fully suppressed due to directed bonds at the contact. Moreover, a charge transfer of 0.6 electrons off the contact aluminium ...
Charge-state distribution and Doppler effect in an expanding photoionized plasma.
Foord, M E; Heeter, R F; van Hoof, P A M; Thoe, R S; Bailey, J E; Cuneo, M E; Chung, H-K; Liedahl, D A; Fournier, K B; Chandler, G A; Jonauskas, V; Kisielius, R; Mix, L P; Ramsbottom, C; Springer, P T; Keenan, F P; Rose, S J; Goldstein, W H
2004-07-30
The charge state distributions of Fe, Na, and F are determined in a photoionized laboratory plasma using high resolution x-ray spectroscopy. Independent measurements of the density and radiation flux indicate unprecedented values for the ionization parameter xi=20-25 erg cm s(-1) under near steady-state conditions. Line opacities are well fitted by a curve-of-growth analysis which includes the effects of velocity gradients in a one-dimensional expanding plasma. First comparisons of the measured charge state distributions with x-ray photoionization models show reasonable agreement.
Microscopic modeling of mass and charge distributions in the spontaneous fission of 240Pu
Sadhukhan, Jhilam; Nazarewicz, Witold; Schunck, Nicolas
2016-01-01
We propose a methodology to calculate microscopically the mass and charge distributions of spontaneous fission yields. We combine the multidimensional minimization of collective action for fission with stochastic Langevin dynamics to track the relevant fission paths from the ground-state configuration up to scission. The nuclear potential energy and collective inertia governing the tunneling motion are obtained with nuclear density functional theory in the collective space of shape deformations and pairing. We obtain a quantitative agreement with experimental data and find that both the charge and mass distributions in the spontaneous fission of 240Pu are sensitive both to the dissipation in collective motion and to adiabatic fission characteristics.
Microscopic modeling of mass and charge distributions in the spontaneous fission of 240Pu
Sadhukhan, Jhilam; Schunck, Nicolas
2016-01-01
In this letter, we outline a methodology to calculate microscopically mass and charge distributions of spontaneous fission yields. We combine the multi-dimensional minimization of collective action for fission with stochastic Langevin dynamics to track the relevant fission paths from the ground-state configuration up to scission. The nuclear potential energy and collective inertia governing the tunneling motion are obtained with nuclear density functional theory in the collective space of shape deformations and pairing. We obtain a quantitative agreement with experimental data and find that both the charge and mass distributions in the spontaneous fission of 240Pu are sensitive both to the dissipation in collective motion and to adiabatic characteristics.
Flat Bunches with a Hollow Distribution for Space Charge Mitigation
Oeftiger, Adrian; Findlay, Alan James; Hancock, Steven; Rumolo, Giovanni
2016-01-01
Longitudinally hollow bunches provide one means to mitigate the impact of transverse space charge. The hollow distributions are created via dipolar parametric excitation during acceleration in CERN's Proton Synchrotron Booster. We present simulation work and beam measurements. Particular emphasis is given to the alleviation of space charge effects on the long injection plateau of the downstream Proton Synchrotron machine, which is the main goal of this study.
Institute of Scientific and Technical Information of China (English)
ZHU; Zhiyan; ZHU; Zhenghe; TANG; Changhuan; TANG; Yongjia
2005-01-01
The present work proposes kinetics of ionization-recombination to study the charge state distribution of Au plasma. The first step is to calculate the average lifetime, energy level structure, degeneracy and partition function of Au48+―Au52+ by relativistic quantum mechanics, and next to compute the equilibrium constant and the second-order recombination rate constant by statistical thermodynamics. Based on these data, the differential equations of consecutive reversible ionization-recombination reactions are solved from which the charge state distribution and its average charge are derived. Finally, the influence of electron temperature and density on average charge is given in this paper. It is called the first-principle theory, for no experimental data are needed.
Theoretical description of nonequilibrium behavior in charge density wave systems
Shen, Wen
The fast development of time resolved photoemission (TRPES) techniques allow us to discover the rich features of nonequilibrium phenomena which may not appear in equilibrium. One of the most explored topics is the nonequilibrium behavior of a charge density wave (CDW) material. Being an ordered phase at low temperature, the CDW state provides a fertile ground to study electron-electron and electron-ion interactions. By driving this material out of equilibrium and taking ultrafast time resolution snapshots of its behavior, TRPES helps us understand these interactions and sheds light on the mechanisms behind these and other complex material properties, such as metal-insulator transitions, high temperature superconductivity, and magnetic phenomena. Recent experiments on TRPES in CDW materials show an ultrafast CDW gap closure in systems such as 1T--TaS2 and TbTe3 and the subsequent separation of time scales for the electron-electron interaction and the electron-lattice interaction. But it is still not clear what happens during the ultrashort period (in first 100 femtosecond). In this dissertation, we solve a two band model describing this ultrafast process in a CDW system. By fixing the lattice distortion effect in the CDW, we studied the nonequilibrium excitations of the electrons under a strong electric field. This research is performed by calculating nonequilibrium Green's functions (NGF) along the Kadanoff-Baym-Keldysh contour. We solved this nonequilibrium problem exactly. We show non-perturbative results and explore the nonlinear electronic behavior under an ultrashort light pulses. In addition to the TRPES problem, we also examined the behavior of Bloch oscillations under a large DC field, the response to an AC electric field, high harmonic generation from solids, and the crossover between frequency-driven excitation and amplitude-driven excitation.
Experimental surface charge density of the Si (100)-2x1H surface
DEFF Research Database (Denmark)
Ciston, J.; Marks, L.D.; Feidenhans'l, R.;
2006-01-01
We report a three-dimensional charge density refinement from x-ray diffraction intensities of the Si (100) 2x1H surface. By paying careful attention to parameterizing the bulk Si bonding, we are able to locate the hydrogen atoms at the surface, which could not be done previously. In addition, we...... are able to partially refine the local charge density at the surface. We find experimentally an increased, slightly localized bond density of approximately 0.31 electrons between each Si atom pair at the surface. Both the atomic positions and the charge density are in remarkably good agreement with density...
Rendering high charge density of states in ionic liquid-gated MoS 2 transistors
Lee, Y.; Lee, J.; Kim, S.; Park, H.S.
2014-01-01
We investigated high charge density of states (DOS) in the bandgap of MoS2 nanosheets with variable temperature measurements on ionic liquid-gated MoS2 transistors. The thermally activated charge transport indicates that the electrical current in the two-dimensional MoS 2 nanosheets under high charg
Directory of Open Access Journals (Sweden)
D. K. Narvilkar
1979-07-01
Full Text Available In the present paper, the equations of internal ballistics of composite charge consisting of N component charge with quadratic form are solved. Largange density approximation and hydrodynamic flow behaviour, have been assumed and the solutions are obtained for the composite charge for these assumptions.
Electron deformation density distribution in α-boron
International Nuclear Information System (INIS)
The bonding features of α-boron were studied using electron density analysis procedures. Deformation density maps and valence density were calculated and the structure analysed by so-called multipole refinements, yielding R = 0.0119. The refinement model correctly describes the bonding and results in a difference density distribution free from any meaningful residual peaks
DEFF Research Database (Denmark)
Tanner, D. B.; Cummings, K. D.; Jacobsen, Claus Schelde
1981-01-01
Detailed far-infrared measurements at temperatures from 25 to 300 K provide strong support for a charge-density-wave mechanism for the dc conductivity and microwave dielectric constant of tetrathiafulvalene tetracyanoquinodimethane (TTF-TCNQ). At low temperatures the charge-density wave is pinned...
Farris, Stefano; Mora, Luigi; Capretti, Giorgio; Piergiovanni, Luciano
2012-01-01
An easy analytical method for determination of the charge density of polyelectrolytes, including polysaccharides and other biopolymers, is presented. The basic principles of conductometric titration, which is used in the pulp and paper industry as well as in colloid and interface science, were adapted to quantify the charge densities of a…
Institute of Scientific and Technical Information of China (English)
LI Zhi-Bing; WANG Wei-Liang
2006-01-01
We derive the analytic solution of induced electrostatic potential along single wall carbon nanotubes. Under the hypothesis of constant density of states in the charge-neutral level, we are able to obtain the linear density of excess charge in an external Geld parallel to the tube axis.
Li, Zhibing; Wang, Weiliang
2006-01-01
We derived the analytic solution of induced electrostatic potential along single wall carbon nanotubes. Under the hypothesis of constant density of states in the charge-neutral level, we are able to obtain the linear density of excess charge in an external field parallel to the tube axis.
Electronic properties and charge density of BeZn1−Te alloys
Indian Academy of Sciences (India)
C B Swarnkar; U Paliwal; N N Patel; K B Joshi
2011-06-01
Electronic band structure calculations are performed for the BeZn1−Te (0 ≤ ≤ 1 in steps of 0.2) alloys following the empirical pseudopotential method. The alloying effects are modelled through the modified virtual crystal approximation. Throughout the composition, valence band maximum resides at the point. The conduction band minimum, however, shifts from to point of symmetry when = 0.27. The observed crossover from direct to indirect bandgap is well in accordance with the experimental observations. Effect of alloying on the density of states is also discussed. The charge density distribution along a few major planes is computed and discussed. The electronic band structure related parameters like bandwidths, bandgaps and ionicity are reported and compared with experimental data wherever available. We also give estimates of cohesive energy and bulk modulus for the alloys.
Topics in the Dynamics of Charge-Density
Ramakrishna, Sathyanarayan (Satish).
This dissertation is an investigation into some interesting transport properties of charge-density-waves (CDWs). The field of CDW dynamics is an arena for the battle between mathematical analysis and random disorder. It is a very difficult physical situation to analyze. The theoretical study of CDW dynamics dates to the prescient suggestion of John Bardeen (in the 70s) that the nonlinear I-V characteristic of the quasi one-dimensional material TTF-TCNQ was a consequence of collective transport of condensate resulting from a Peierls instability. This instability, described first by Peierls, is studied in Chapter 1. Once the underlying physics of the instability was understood, the effects of coupling the CDW to impurities and to electric and magnetic fields were studied. The most striking effect of impurities is to produce CDW pinning, so that collective-mode transport ceases to occur if the applied electric field is smaller than a threshold field. Intensive research led to the Fukuyama-Lee-Rice model of CDW pinning. Experiments in the field are complicated by the difficulty in preparing well characterized samples of the relevant materials, among which are the trichalco-genides NbSe_3, TaS_3, the dichalcogenides (TaSe_4)_2I, TaS_2, NbSe_2 and blue bronze K_{0.3}MoO _3. Over the last decade, growth techniques have been perfected and intensive comparison between the various theoretical models and experiment is feasible. An outline of the dissertation is as follows. First, we review the theoretical ideas that underlie the subject. Then we discuss each new piece of work separately. First, this thesis presents one important theoretical approach to the study of CDW dynamics. The approach builds upon previous work on the microscopic theory of superconductors and results in a new formulation of the problem that seems likely to lend itself to non-perturbative approaches. The perturbative approach cannot provide answers to the question of what happens near the depinning
Quantum coherent switch utilizing commensurate nanoelectrode and charge density periodicities
Harrison, Neil; Singleton, John; Migliori, Albert
2008-08-05
A quantum coherent switch having a substrate formed from a density wave (DW) material capable of having a periodic electron density modulation or spin density modulation, a dielectric layer formed onto a surface of the substrate that is orthogonal to an intrinsic wave vector of the DW material; and structure for applying an external spatially periodic electrostatic potential over the dielectric layer.
Formation and migration of space charge packet in low density polyethylene
Institute of Scientific and Technical Information of China (English)
ZHENG; Feihu; ZHANG; Yewen; GONG; Bin; ZHU; Jianwei; WU; Ch
2005-01-01
Pressure wave propagation (PWP) method was utilized to observe the space charges packet-like behavior in sheet samples of low-density polyethylene (LDPE) under the relative low electric field. The experimental results show that space charge packets are always generated at the anode and move across the sample to the cathode regardless of the polarity of DC voltage. This paper discusses the migration of space charge packets at 30-40℃, the possible charge resource of space charge packets carriers and trap level of the space charge.
Connection between elastic relativistic form factors and charge distribution
International Nuclear Information System (INIS)
A scheme by means of which one can establish the connection between form factors and charge distribution (for particles of any spin) in proposed. Except for the nonrelativistic domain our results differ from previous ones. Consequences of our relations (some of them in agreement with experimental and previous theoretical results) are briefly discussed
Response of electrostatic probes to eccentric charge distributions
DEFF Research Database (Denmark)
Johansson, Torben; McAllister, Iain Wilson
2001-01-01
The response of an electrostatic probe mounted in an electrode is examined with reference to eccentric charge distributions. The study involves using the probe λ function to derive a characteristic parameter. This parameter enables the response of the probe to different degrees of eccentricity to...
Ion energy distributions and densities in the plume of Enceladus
Sakai, Shotaro; Cravens, Thomas E.; Omidi, Nojan; Perry, Mark E.; Waite, J. Hunter
2016-10-01
Enceladus has a dynamic plume that is emitting gas, including water vapor, and dust. The gas is ionized by solar EUV radiation, charge exchange, and electron impact and extends throughout the inner magnetosphere of Saturn. The charge exchange collisions alter the plasma composition. Ice grains (dust) escape from the vicinity of Enceladus and form the E ring, including a portion that is negatively charged by the local plasma. The inner magnetosphere within 10 RS (Saturn radii) contains a complex mixture of plasma, neutral gas, and dust that links back to Enceladus. In this paper we investigate the energy distributions, ion species and densities of water group ions in the plume of Enceladus using test particle and Monte Carlo methods that include collisional processes such as charge exchange and ion-neutral chemical reactions. Ion observations from the Cassini Ion and Neutral Mass Spectrometer (INMS) for E07 are presented for the first time. We use the modeling results to interpret observations made by the Cassini Plasma Spectrometer (CAPS) and the INMS. The low energy ions, as observed by CAPS, appear to be affected by a vertical electric field (EZ=-10 μV/m) in the plume. The EZ field may be associated with the charged dust and/or the pressure gradient of plasma. The model results, along with the results of earlier models, show that H3O+ ions created by chemistry are predominant in the plume, which agrees with INMS and CAPS data, but the INMS count rate in the plume for the model is several times greater than the data, which we do not fully understand. This composition and the total ion count found in the plume agree with INMS and CAPS data. On the other hand, the Cassini Langmuir Probe measured a maximum plume ion density more than 30,000 cm-3, which is far larger than the maximum ion density from our model, 900 cm-3. The model results also demonstrate that most of the ions in the plume are from the external magnetospheric flow and are not generated by local
Charged Hadron Multiplicity Distribution at Relativistic Heavy-Ion Colliders
Directory of Open Access Journals (Sweden)
Ashwini Kumar
2013-01-01
Full Text Available The present paper reviews facts and problems concerning charge hadron production in high energy collisions. Main emphasis is laid on the qualitative and quantitative description of general characteristics and properties observed for charged hadrons produced in such high energy collisions. Various features of available experimental data, for example, the variations of charged hadron multiplicity and pseudorapidity density with the mass number of colliding nuclei, center-of-mass energies, and the collision centrality obtained from heavy-ion collider experiments, are interpreted in the context of various theoretical concepts and their implications. Finally, several important scaling features observed in the measurements mainly at RHIC and LHC experiments are highlighted in the view of these models to draw some insight regarding the particle production mechanism in heavy-ion collisions.
Papoulia, A.; Carlsson, B. G.; Ekman, J
2016-01-01
Background: Atomic spectral lines from different isotopes display a small shift in energy, commonly referred to as the line isotope shift. One of the components of the isotope shift is the field shift, which depends on the extent and the shape of the nuclear charge density distribution. Purpose: To investigate how sensitive field shifts are with respect to variations in the nuclear size and shape and what information of nuclear charge distributions that can be extracted from measured field sh...
DEFF Research Database (Denmark)
Beleggia, Marco; Kasama, Takeshi; Dunin-Borkowski, Rafal E.;
2011-01-01
Nanowires and nanotubes can be examined in the transmission electron microscope under an applied bias. Here we introduce a model-independent method, which allows the charge distribution along a nanowire or nanotube to be measured directly from the Laplacian of an electron holographic phase image........ We present results from a biased bundle of carbon nanotubes, in which we show that the charge density increases linearly with distance from its base, reaching a value of ~0.8 electrons/nm near its tip.......Nanowires and nanotubes can be examined in the transmission electron microscope under an applied bias. Here we introduce a model-independent method, which allows the charge distribution along a nanowire or nanotube to be measured directly from the Laplacian of an electron holographic phase image...
A thundercloud electric field sounding - Charge distribution and lightning
Weber, M. E.; Few, A. A.; Stewart, M. F.; Christian, H. J.
1982-01-01
An instrumented free balloon measured electric fields and field changes as it rose through a thundercloud above Langmuir Laboratory, New Mexico. The variation of the electric field with altitude implied that the cloud contained negative space charge of density -0.6 to -4 nC/cu m between 5.5 and 8.0 km MSL. The environmental temperature at these levels ranged from -5 to -20 C. The measurements imply that the areal extent of this negative charge center was significantly greater than that of the cloud's intense precipitation shafts. At altitudes greater than 8 km, the instrument ascended past net positive charge. In addition, positive space charge adjacent to the earth's surface (concentration 0.6 nC/cu m and in the lowest portion of the cloud (1.0 nC/cu m) is inferred from the measurements. Electric field changes from intracloud lightning were interpreted by using a simple model for the developing streamer of the initial phase. Thunder source reconstructions provided estimates for the orientation of lightning channels. Seven 'streamers' so analyzed propagated on the average, at 50,000 m/s and carried a current of 390 A. The mean charge dissipated during a flash was 30 C.
Charge and spin density in s-stable rare earth intermetallic compounds
International Nuclear Information System (INIS)
This thesis deals with a study of the electronic structure of rare earth intermetallic compounds, in particular the electronic charge and spin density distribution. These are closely related to the properties of the rare earth ions, which carry the partly filled 4f shell. In chapter 1 a survey of the theory of hyperfine interaction as far as it has a bearing on the Moessbauer effect of 155Gd and 151Eu is given. Also some details of the Moessbauer spectra, which have practical importance are discussed. In chapter 2 the experimental set-up is described. Special attention is paid to the gamma radiation source and gamma detection requirements. In chapter 3 the author introduces the theoretical framework which will be used to interpret the measurements. In chapter 4 the results of the 155Gd Moessbauer measurements are presented. Also it is discussed how the result can be understood in terms of the charge and spin density in rare earth intermetallic compounds. In order to lend support to the picture emerging from the previous chapter, in chapter 5 the conduction electron band structure of some representative Gd intermetallics is computed with an approximate semi-empirical LCAO method. The results are compared with those from chapter 4. Finally, in chapter 6, the 151Eu resonance is used to investigate the temperature dependence of the hyperfine field and line width in the Eu intermetallic compounds Eu2Mg17 and EuMg5. (Auth.)
Sun, Xu; Yao, Tao; Hu, Zhenpeng; Guo, Yuqiao; Liu, Qinghua; Wei, Shiqiang; Wu, Changzheng
2015-05-28
A deep understanding of the relationship between electronic and structure ordering across the charge-density-wave (CDW) transition is crucial for both fundamental study and technological applications. Herein, using in situ X-ray absorption fine structure (XAFS) spectroscopy coupled with high-resolution transmission electron microscopy (HRTEM), we have illustrated the atomic-level information on the local structural evolution across the CDW transition and its influence on the intrinsic electrical properties in VS2 system. The structure transformation, which is highlighted by the formation of vanadium trimers with derivation of V-V bond length (ΔR = 0.10 Å), was clearly observed across the CDW process. Moreover, the corresponding influence of lattice variation on the electronic behavior was clearly characterized by experimental results as well as theoretical analysis, which demonstrated that vanadium trimers drive the deformation of space charge density distribution into √3 ×√3 periodicity, with the conductivity of a1g band reducing by half. These observations directly unveiled the close connection between lattice evolution and electronic property variation, paving a new avenue for understanding the intrinsic nature of electron-lattice interactions in the VS2 system and other isostructural transition metal dichalcogenides across the CDW transition process.
Solar concentrators with adjustable power density distributions
Energy Technology Data Exchange (ETDEWEB)
Kleinwaechter, J.
1977-09-01
Solar concentrators are described which provide given power density in the absorber. According to the invention, 'semi-optical' lenses and mirrors are used to concentrate the incident solar radiation; these elements image the solar disk not as a point but as an area of constant illumination intensity on the absorber. This is achieved by a functional locus-dependecy of refraction and reflection. For mirror concentration, a differential equation is given which satisfies this functional dependency.
Kumar, Naveen; Zhao, Cunlu; Klaassen, Aram; van den Ende, Dirk; Mugele, Frieder; Siretanu, Igor
2016-02-01
Most solid surfaces, in particular clay minerals and rock surfaces, acquire a surface charge upon exposure to an aqueous environment due to adsorption and/or desorption of ionic species. Macroscopic techniques such as titration and electrokinetic measurements are commonly used to determine the surface charge and ζ -potential of these surfaces. However, because of the macroscopic averaging character these techniques cannot do justice to the role of local heterogeneities on the surfaces. In this work, we use dynamic atomic force microscopy (AFM) to determine the distribution of surface charge on the two (gibbsite-like and silica-like) basal planes of kaolinite nanoparticles immersed in aqueous electrolyte with a lateral resolution of approximately 30 nm. The surface charge density is extracted from force-distance curves using DLVO theory in combination with surface complexation modeling. While the gibbsite-like and the silica-like facet display on average positive and negative surface charge values as expected, our measurements reveal lateral variations of more than a factor of two on seemingly atomically smooth terraces, even if high resolution AFM images clearly reveal the atomic lattice on the surface. These results suggest that simple surface complexation models of clays that attribute a unique surface chemistry and hence homogeneous surface charge densities to basal planes may miss important aspects of real clay surfaces.
Reallocating Charging Loads of Electric Vehicles in Distribution Networks
Directory of Open Access Journals (Sweden)
Mohammed Jasim M. Al Essa
2016-02-01
Full Text Available In this paper, the charging loads of electric vehicles were controlled to avoid their impact on distribution networks. A centralized control algorithm was developed using unbalanced optimal power flow calculations with a time resolution of one minute. The charging loads were optimally reallocated using a central controller based on non-linear programming. Electric vehicles were recharged using the proposed control algorithm considering the network constraints of voltage magnitudes, voltage unbalances, and limitations of the network components (transformers and cables. Simulation results showed that network components at the medium voltage level can tolerate high uptakes of uncontrolled recharged electric vehicles. However, at the low voltage level, network components exceeded their limits with these high uptakes of uncontrolled charging loads. Using the proposed centralized control algorithm, these high uptakes of electric vehicles were accommodated in the network under study without the need of upgrading the network components.
Charging Schedule for Electric Vehicles in Danish Residential Distribution Grids
DEFF Research Database (Denmark)
Pillai, Jayakrishnan Radhakrishna; Huang, Shaojun; Bak-Jensen, Birgitte;
2015-01-01
The prospects of Electric Vehicles (EVs) in providing clean transportation and supporting renewable electricity is widely discussed in sustainable energy forums worldwide. The battery storage of EVs could be used to address the variability and unpredictability of electricity produced from renewable......, the vehicle owner, vehicle fleet operator and other parties involved in the process could economically benefit from the process. This paper investigates an optimal EV charging plan in Danish residential distribution grids in view of supporting high volumes of wind power in electricity grids. The results...... of the analysis show that the charging of the EVs could ensure effective demand response in the local grids, within the existing grid capabilities and random charging patterns of EVs....
Changes of the Nuclear Charge Distribution of Nd from Optical Isotope Shifts
Institute of Scientific and Technical Information of China (English)
马洪良; 李茂生; 杨福家
2001-01-01
The isotope shifts and hyperfine structures of seven optical transitions for all seven stable isotopes of Nd Ⅱ were measured by using collinear fast-ion-beam laser spectroscopy. The nuclear parameter λ was obtained from the measured optical isotope shifts for alI seven stable isotopes with improved accuracy. The λ values were analysed by using the Fermi distribution for the nuclear charge density. The values of δ, δ and δ were determined.
Ion distributions at charged aqueous surfaces: Synchrotron X-ray scattering studies
Energy Technology Data Exchange (ETDEWEB)
Bu, Wei [Iowa State Univ., Ames, IA (United States)
2009-01-01
Surface sensitive synchrotron X-ray scattering studies were performed to obtain the distribution of monovalent ions next to a highly charged interface at room temperature. To control surface charge density, lipids, dihexadecyl hydrogen-phosphate (DHDP) and dimysteroyl phosphatidic acid (DMPA), were spread as monolayer materials at the air/water interface, containing CsI at various concentrations. Five decades in bulk concentrations (CsI) are investigated, demonstrating that the interfacial distribution is strongly dependent on bulk concentration. We show that this is due to the strong binding constant of hydronium H3O+ to the phosphate group, leading to proton-transfer back to the phosphate group and to a reduced surface charge. Using anomalous reflectivity off and at the L3 Cs+ resonance, we provide spatial counterion (Cs+) distributions next to the negatively charged interfaces. The experimental ion distributions are in excellent agreement with a renormalized surface charge Poisson-Boltzmann theory for monovalent ions without fitting parameters or additional assumptions. Energy Scans at four fixed momentum transfers under specular reflectivity conditions near the Cs+ L3 resonance were conducted on 10-3 M CsI with DHDP monolayer materials on the surface. The energy scans exhibit a periodic dependence on photon momentum transfer. The ion distributions obtained from the analysis are in excellent agreement with those obtained from anomalous reflectivity measurements, providing further confirmation to the validity of the renormalized surface charge Poisson-Boltzmann theory for monovalent ions. Moreover, the dispersion corrections f0 and f00 for Cs+ around L3 resonance, revealing the local environment of a Cs+ ion in the solution at the interface, were extracted simultaneously with output of ion distributions.
Influence of Electric Charge and Modified Gravity on Density Irregularities
Bhatti, M Zaeem Ul Haq
2016-01-01
This work aims to identify some inhomogeneity factors for plane symmetric topology with anisotropic and dissipative fluid under the effects of both electromagnetic field as well as Palatini $f(R)$ gravity. We construct the modified field equations, kinematical quantities and mass function to continue our analysis. We have explored the dynamical quantities, conservation equations and modified Ellis equations with the help of a viable $f(R)$ model. Some particular cases are discussed with and without dissipation to investigate the corresponding inhomogeneity factors. For non-radiating scenario, we examine such factors with dust, isotropic and anisotropic matter in the presence of charge. For dissipative fluid, we investigate the inhomogeneity factor with charged dust cloud. We conclude that electromagnetic field increases the inhomogeneity in matter while the extra curvature terms make the system more homogeneous with the evolution of time.
Molecular Weight and Charge Density Asymmetry in Polyelectrolyte Complexation
Audus, Debra; Fredrickson, Glenn; Duechs, Dominik
2009-03-01
We investigate the phase diagram of oppositely charged polymers in a good solvent using a field-theoretic model. Mean-field solutions fail to predict the experimentally observed macroscopic phase separation into a solvent-rich phase and a dense liquid aggregate of polymers - a ``complex coacervate.'' We therefore study the model within a one-loop approximation, which accounts for Gaussian fluctuations in electrostatic and chemical potentials. Our particular focus is the effect of molecular weight, ionic strength, and charge asymmetry on the phase envelope. A set of dimensionless parameters is identified that dictate the size and shape of the two-phase region. Our results should be helpful in guiding experimental studies of coacervation.
Influence of electric charge and modified gravity on density irregularities
Energy Technology Data Exchange (ETDEWEB)
Bhatti, M.Z. Ul Haq; Yousaf, Z. [University of the Punjab, Department of Mathematics, Lahore (Pakistan)
2016-04-15
This work aims to identify some inhomogeneity factors for a plane symmetric topology with anisotropic and dissipative fluid under the effects of both electromagnetic field as well as Palatini f(R) gravity. We construct the modified field equations, kinematical quantities, and mass function to continue our analysis. We have explored the dynamical quantities, conservation equations and modified Ellis equations with the help of a viable f(R) model. Some particular cases are discussed with and without dissipation to investigate the corresponding inhomogeneity factors. For a non-radiating scenario, we examine such factors as dust, and isotropic and anisotropic matter in the presence of charge. For a dissipative fluid, we investigate the inhomogeneity factor with a charged dust cloud. We conclude that the electromagnetic field increases the inhomogeneity in matter while the extra curvature terms make the system more homogeneous with the evolution of time. (orig.)
Melting Point Of Metals In Relation Io Electron Charge Density
Directory of Open Access Journals (Sweden)
Boczkal G.
2015-09-01
Full Text Available The concept of spatial criterion of the electron charge concentration is applied to determine the metal melting point. Based on the model proposed for bcc metals, a model for hcp metals and general form for others has been developed. To calculate the melting point, only structural data and atomic number are required. The obtained results show good consistency with the experimental data for metals with atomic number Z < 70.
Velocity Distributions & Density Fluctuations in a 2D Granular Gas
Olafsen, J. S.; Urbach, J. S.
1999-01-01
Velocity distributions in a vibrated granular monolayer are investigated experimentally. Non-Gaussian velocity distributions are observed at low vibration amplitudes but cross over smoothly to Gaussian distributions as the amplitude is increased. Cross-correlations between fluctuations in density and temperature are present only when the velocity distributions are strongly non-Gaussian. Confining the expansion of the granular layer results in non-Gaussian velocity distributions that persist t...
Anode current density distribution in a cusped field thruster
Energy Technology Data Exchange (ETDEWEB)
Wu, Huan, E-mail: wuhuan58@qq.com; Liu, Hui, E-mail: hlying@gmail.com; Meng, Yingchao; Zhang, Junyou; Yang, Siyu; Hu, Peng; Chen, Pengbo; Yu, Daren [Mail Box 458, Harbin Institute of Technology (HIT), Harbin 150001 (China)
2015-12-15
The cusped field thruster is a new electric propulsion device that is expected to have a non-uniform radial current density at the anode. To further study the anode current density distribution, a multi-annulus anode is designed to directly measure the anode current density for the first time. The anode current density decreases sharply at larger radii; the magnitude of collected current density at the center is far higher compared with the outer annuli. The anode current density non-uniformity does not demonstrate a significant change with varying working conditions.
Ionic strength independence of charge distributions in solvation of biomolecules
Virtanen, J. J.; Sosnick, T. R.; Freed, K. F.
2014-01-01
Electrostatic forces enormously impact the structure, interactions, and function of biomolecules. We perform all-atom molecular dynamics simulations for 5 proteins and 5 RNAs to determine the dependence on ionic strength of the ion and water charge distributions surrounding the biomolecules, as well as the contributions of ions to the electrostatic free energy of interaction between the biomolecule and the surrounding salt solution (for a total of 40 different biomolecule/solvent combinations...
Initial Distribution Spread: A density forecasting approach
Machete, Reason L
2012-01-01
Ensemble forecasting of nonlinear systems involves the use of a model to run forward a discrete ensemble (or set) of initial states. Data assimilation techniques tend to focus on estimating the true state of the system, even though model error limits the value of such efforts. This paper argues for choosing the initial ensemble in order to optimise forecasting performance rather than estimate the true state of the system. Density forecasting and choosing the initial ensemble are treated as one problem. Forecasting performance can be quantified by some scoring rule. In the case of the logarithmic scoring rule, theoretical arguments and empirical results are presented. It turns out that, if the underlying noise dominates model error, we can diagnose the noise spread.
Comparison of the charge distributions of the titanium isotopes
International Nuclear Information System (INIS)
Measurements have been made of the elastic electron scattering from the three even isotopes of titanium, Ti46, Ti48, and Ti50, with the objective of determining the differences in their ground state charge distributions. The experiment measures the ratios of the elastic cross sections of the three isotopes, thereby eliminating many of the uncertainties peculiar to an absolute cross section measurement. The experiment was done at the NBS Linac in Gaithersburg, Maryland. Theoretical calculations using a partial wave elastic scattering program, showed that the ratios of cross sections arising from scattering from two slightly different Fermi type 2 parameter charge distributions, depended strongly on the differences in the parameter describing the charge distribution, but only weakly on the actual values of these parameters. These ratio curves, considered as a function of momentum transfer, achieved their extreme values at momenta transfer near 1.0 F-1, which is near the point where the Born approximation form factor goes to zero. Therefore, ratios of cross sections were measured at momenta transfer ranging from .55 to 1.1 F-1; by holding the scattering angle fixed at 127.50 and varying the incident beam energy from 60 to 123 MeV. 43 refs., 45 figs., 9 tabs
Mapping surface charge density of lipid bilayers by quantitative surface conductivity microscopy
Klausen, Lasse Hyldgaard; Fuhs, Thomas; Dong, Mingdong
2016-08-01
Local surface charge density of lipid membranes influences membrane-protein interactions leading to distinct functions in all living cells, and it is a vital parameter in understanding membrane-binding mechanisms, liposome design and drug delivery. Despite the significance, no method has so far been capable of mapping surface charge densities under physiologically relevant conditions. Here, we use a scanning nanopipette setup (scanning ion-conductance microscope) combined with a novel algorithm to investigate the surface conductivity near supported lipid bilayers, and we present a new approach, quantitative surface conductivity microscopy (QSCM), capable of mapping surface charge density with high-quantitative precision and nanoscale resolution. The method is validated through an extensive theoretical analysis of the ionic current at the nanopipette tip, and we demonstrate the capacity of QSCM by mapping the surface charge density of model cationic, anionic and zwitterionic lipids with results accurately matching theoretical values.
Determination of charge carrier mobility in doped low density polyethylene using DC transients
DEFF Research Database (Denmark)
Khalil, M.Salah; Henk, Peter O; Henriksen, Mogens
1989-01-01
Charge carrier mobility was determined for plain and doped low-density polyethylene (LDPE) using DC transient currents. Barium titanate was used as a strongly polar dopant and titanium dioxide as a semiconductor dopant. The values of the mobility obtained were on the order of 10-10 cm2 v-1 s-1...... by a factor of five. Charge trapping and space charge formation were modified by the introduction of titanium dioxide...
Electromagnetic contribution to charge symmetry violation in parton distributions
Directory of Open Access Journals (Sweden)
X.G. Wang
2016-02-01
Full Text Available We report a calculation of the combined effect of photon radiation and quark mass differences on charge symmetry violation (CSV in the parton distribution functions of the nucleon. Following a recent suggestion of Martin and Ryskin, the initial photon distribution is calculated in terms of coherent radiation from the proton as a whole, while the effect of the quark mass difference is based on a recent lattice QCD simulation. The distributions are then evolved to a scale at which they can be compared with experiment by including both QCD and QED radiation. Overall, at a scale of 5 GeV2, the total CSV effect on the phenomenologically important difference between the d and u-quark distributions is some 20% larger than the value based on quark mass differences alone. In total these sources of CSV account for approximately 40% of the NuTeV anomaly.
Chiral anomaly, Charge Density Waves, and Axion Strings from Weyl Semimetals
Wang, Zhong; Zhang, Shou-Cheng
2012-01-01
We study dynamical instability and chiral symmetry breaking in three dimensional Weyl semimetals, which turns Weyl semimetals into "axion insulators". Charge density waves (CDW) is found to be the natural consequence of the chiral symmetry breaking. The phase mode of this charge density wave state is identified as the axion, which couples to electromagnetic field in the topological $\\theta{\\bf E}\\cdot{\\bf B}$ term. One of our main results is that the "axion strings" can be realized as the (sc...
Photoinduced Dynamics in the Charge Density Wave Compound 4HB-TaSe2
Directory of Open Access Journals (Sweden)
Demsar J.
2013-03-01
Full Text Available We report on ultrafast photoindued charge density wave (CDW dynamics in the transition-metal dichalcogenide 4Hb-TaSe2, studied with ultrafast electron diffraction. Fluence dependence of the lattice superstructure suppression show a phase transition from the commensurate to the incommensurate phase of 4Hb-TaSe2. Unusually long recovery times of perturbed charge density waves indicate th importance of a coupling between the two dimensional CDWs.
Kumar, Amit; POUMIROL, Jean-Marie; Escoffier, Walter; Goiran, Michel; Raquet, Bertrand; Pivin, Jean Claude
2010-01-01
We report on the investigation of magnetic field induced charge density wave and Hall coefficient sign reversal in a quasi-two dimensional electronic system of highly oriented pyrolytic graphite under very strong magnetic field. The change of Hall sign coefficient from negative to positive occurs at low temperature and high magnetic field just after the charge density wave transition, suggesting the role of hole-like quasi-particles in this effect. Angular dependent measurements show that the...
Ion Density Distribution in an Inductively Coupled Plasma Chamber
Institute of Scientific and Technical Information of China (English)
陈俊芳; 赵文锋; 吴先球; 樊双莉; 符斯列
2004-01-01
The ion density distribution in the reaction chamber was diagnosed by a Langmuir probe. The rules of the ion density distribution were obtained under the pressures of 9 Pa, 13 Pa,27 Pa and 53 Pa in the reaction chamber, different radio-frequency powers and different positions.The result indicates that the ion density decreases as the pressure increases, and increases as the power decreases. The ion density of axial position z = 0 achieves 5.8×10 10 on the center of coil under the power of 200 w and pressure of 9 Pa in the reaction chamber.
Einasto as a new approach for noncommutativity density distribution?
Hernandez-Almada, Alberto
2016-01-01
In this paper we analyze the galaxy rotation curves using a density profile that comes from noncommutativity (NC) theory. We will refer to this distribution as NC density. In this case, we use the Einasto's density profile as a reference due that it is a generalized case of NC distribution and is one of the most successful phenomenological profiles to describe the rotation curve of galaxies. Based on these results, we open a discussion if Einasto's profile could be used as an extension of NC density and if could be applied to other studies treated by this theory.
ON THE ORIGIN OF THE HIGH COLUMN DENSITY TURNOVER IN THE H I COLUMN DENSITY DISTRIBUTION
International Nuclear Information System (INIS)
We study the high column density regime of the H I column density distribution function and argue that there are two distinct features: a turnover at NHI ≈ 1021 cm–2, which is present at both z = 0 and z ≈ 3, and a lack of systems above NHI ≈ 1022 cm–2 at z = 0. Using observations of the column density distribution, we argue that the H I-H2 transition does not cause the turnover at NHI ≈ 1021 cm–2 but can plausibly explain the turnover at NHI ∼> 1022 cm–2. We compute the H I column density distribution of individual galaxies in the THINGS sample and show that the turnover column density depends only weakly on metallicity. Furthermore, we show that the column density distribution of galaxies, corrected for inclination, is insensitive to the resolution of the H I map or to averaging in radial shells. Our results indicate that the similarity of H I column density distributions at z = 3 and 0 is due to the similarity of the maximum H I surface densities of high-z and low-z disks, set presumably by universal processes that shape properties of the gaseous disks of galaxies. Using fully cosmological simulations, we explore other candidate physical mechanisms that could produce a turnover in the column density distribution. We show that while turbulence within giant molecular clouds cannot affect the damped Lyα column density distribution, stellar feedback can affect it significantly if the feedback is sufficiently effective in removing gas from the central 2-3 kpc of high-redshift galaxies. Finally, we argue that it is meaningful to compare column densities averaged over ∼ kpc scales with those estimated from quasar spectra that probe sub-pc scales due to the steep power spectrum of H I column density fluctuations observed in nearby galaxies.
Dimensionality-driven phonon softening and incipient charge density wave instability in TiS2
Dolui, Kapildeb; Sanvito, Stefano
2016-08-01
Density functional theory and density functional perturbation theory are used to investigate the electronic and vibrational properties of TiS2. Within the local density approximation the material is a semimetal both in the bulk and in the monolayer form. Most interestingly we observe a Kohn anomaly in the bulk phonon dispersion, which turns into a charge density wave instability when TiS2 is thinned to less than four monolayers. Such instability, however, disappears when one calculates the electronic structure with a functional, such as the LDA+U, which returns an insulating ground state. In this situation charge-doping or strain does not bring back the charge density wave instability, whereas the formation of the TiSSe alloy does.
Directory of Open Access Journals (Sweden)
Yongjun Ahn
Full Text Available The charging infrastructure location problem is becoming more significant due to the extensive adoption of electric vehicles. Efficient charging station planning can solve deeply rooted problems, such as driving-range anxiety and the stagnation of new electric vehicle consumers. In the initial stage of introducing electric vehicles, the allocation of charging stations is difficult to determine due to the uncertainty of candidate sites and unidentified charging demands, which are determined by diverse variables. This paper introduces the Estimating the Required Density of EV Charging (ERDEC stations model, which is an analytical approach to estimating the optimal density of charging stations for certain urban areas, which are subsequently aggregated to city level planning. The optimal charging station's density is derived to minimize the total cost. A numerical study is conducted to obtain the correlations among the various parameters in the proposed model, such as regional parameters, technological parameters and coefficient factors. To investigate the effect of technological advances, the corresponding changes in the optimal density and total cost are also examined by various combinations of technological parameters. Daejeon city in South Korea is selected for the case study to examine the applicability of the model to real-world problems. With real taxi trajectory data, the optimal density map of charging stations is generated. These results can provide the optimal number of chargers for driving without driving-range anxiety. In the initial planning phase of installing charging infrastructure, the proposed model can be applied to a relatively extensive area to encourage the usage of electric vehicles, especially areas that lack information, such as exact candidate sites for charging stations and other data related with electric vehicles. The methods and results of this paper can serve as a planning guideline to facilitate the extensive
Ahn, Yongjun; Yeo, Hwasoo
2015-01-01
The charging infrastructure location problem is becoming more significant due to the extensive adoption of electric vehicles. Efficient charging station planning can solve deeply rooted problems, such as driving-range anxiety and the stagnation of new electric vehicle consumers. In the initial stage of introducing electric vehicles, the allocation of charging stations is difficult to determine due to the uncertainty of candidate sites and unidentified charging demands, which are determined by diverse variables. This paper introduces the Estimating the Required Density of EV Charging (ERDEC) stations model, which is an analytical approach to estimating the optimal density of charging stations for certain urban areas, which are subsequently aggregated to city level planning. The optimal charging station's density is derived to minimize the total cost. A numerical study is conducted to obtain the correlations among the various parameters in the proposed model, such as regional parameters, technological parameters and coefficient factors. To investigate the effect of technological advances, the corresponding changes in the optimal density and total cost are also examined by various combinations of technological parameters. Daejeon city in South Korea is selected for the case study to examine the applicability of the model to real-world problems. With real taxi trajectory data, the optimal density map of charging stations is generated. These results can provide the optimal number of chargers for driving without driving-range anxiety. In the initial planning phase of installing charging infrastructure, the proposed model can be applied to a relatively extensive area to encourage the usage of electric vehicles, especially areas that lack information, such as exact candidate sites for charging stations and other data related with electric vehicles. The methods and results of this paper can serve as a planning guideline to facilitate the extensive adoption of electric
Calculation of ion charge-state distribution in ECR ion sources
International Nuclear Information System (INIS)
Starting with the pioneering efforts of Y. Yongen (Louvain-la-Neuve, Belgium) a code has been developed to calculate the equilibrium ion charge-state distribution for electron-cyclotron resonance source (ECR) ion sources. Production of ions is caused by the impact ionization of the charge gas from ECR-heated electrons of a few keV. Loss of an ion of a given charge state is from charge exchange and radiative recombination. Ultimately, the ion flows out of the minimum-B containment region. The ion confinement times are calculated using an ion-trap-potential model which is based upon modeling calculations done at Lawrence Livermore National Laboratory (LLNL) for the Tandem Mirror Machine. Using this model requires the self-consistent determination of the trap potential and thermal electron density in the plasma. Code inputs are gas natural density, hot-electron temperature and density, ion temperature, cold-electron temperature, mirror ratio, physical dimensions, and atomic-physics data. Other than that there are no adjustable parameters. Results of comparison of calculations with the limited available data are reasonable
Basu, Sumit; Nayak, Tapan K.; Datta, Kaustuv
2016-06-01
Heavy-ion collisions at the Relativistic Heavy Ion Collider at Brookhaven National Laboratory and the Large Hadron Collider at CERN probe matter at extreme conditions of temperature and energy density. Most of the global properties of the collisions can be extracted from the measurements of charged-particle multiplicity and pseudorapidity (η ) distributions. We have shown that the available experimental data on beam energy and centrality dependence of η distributions in heavy-ion (Au +Au or Pb +Pb ) collisions from √{sNN}=7.7 GeV to 2.76 TeV are reasonably well described by the AMPT model, which is used for further exploration. The nature of the η distributions has been described by a double Gaussian function using a set of fit parameters, which exhibit a regular pattern as a function of beam energy. By extrapolating the parameters to a higher energy of √{sNN}=5.02 TeV, we have obtained the charged-particle multiplicity densities, η distributions, and energy densities for various centralities. Incidentally, these results match well with some of the recently published data by the ALICE Collaboration.
Dust Particle Density and Charges in Radio-Frequency Mixture Discharge Plasma
Institute of Scientific and Technical Information of China (English)
WU Jing; ZHANG Peng-Yun; SUN Ji-Zhong; YAO Lie-Ming; DUAN Xu-Ru
2011-01-01
@@ We develop a method for measuring the density and charges of dust particles in a capacitive coupled cylinder discharge chamber in mixtures of gases SiH4/C2H4/Ar.Dust particles are created in situ using these reactive mixtures in rf discharge.A Langmuir probe is employed for the measurement of important plasma parameters,such as electron density,electron temperature and ion density.The density and charges of dust particles is then calculated based on the data of the measurement of these parameters and a known dust plasma sheath model.The curves of dust particle density versus rf power and gas pressure are presented,respectively,under various experimental conditions.The dust charges versus different experimental conditions are also evaluated and presented.%We develop a method for measuring the density and charges of dust particles in a capacitive coupled cylinder discharge chamber in mixtures of gases SiH4/C2H4/Ar. Dust particles are created in situ using these reactive mixtures in rf discharge. A Langmuir probe is employed for the measurement of important plasma parameters, such as electron density, electron temperature and ion density. The density and charges of dust particles is then calculated based on the data of the measurement of these parameters and a known dust plasma sheath model. The curves of dust particle density versus rf power and gas pressure are presented, respectively, under various experimental conditions. The dust charges versus different experimental conditions are also evaluated and presented.
Supergravity and the jet quenching parameter in the presence of R-charge densities
Avramis, S D; Avramis, Spyros D.; Sfetsos, Konstadinos
2007-01-01
We employ the AdS/CFT correspondence to compute the jet quenching parameter for N=4 Yang-Mills theory at nonzero R-charge densities. Using as dual supergravity backgrounds non-extremal rotating branes, we find that the presence of the R-charges generically enhances the jet quenching phenomenon. However, at fixed temperature, this enhancement might or might not be a monotonically increasing function of the R-charge density and depends on the number of independent angular momenta describing the solution. We perform our analysis for the canonical as well as for the grand canonical ensemble which give qualitatively similar results.
Solute location in a nanoconfined liquid depends on charge distribution
Energy Technology Data Exchange (ETDEWEB)
Harvey, Jacob A.; Thompson, Ward H., E-mail: wthompson@ku.edu [Department of Chemistry, University of Kansas, Lawrence, Kansas 66045 (United States)
2015-07-28
Nanostructured materials that can confine liquids have attracted increasing attention for their diverse properties and potential applications. Yet, significant gaps remain in our fundamental understanding of such nanoconfined liquids. Using replica exchange molecular dynamics simulations of a nanoscale, hydroxyl-terminated silica pore system, we determine how the locations explored by a coumarin 153 (C153) solute in ethanol depend on its charge distribution, which can be changed through a charge transfer electronic excitation. The solute position change is driven by the internal energy, which favors C153 at the pore surface compared to the pore interior, but less so for the more polar, excited-state molecule. This is attributed to more favorable non-specific solvation of the large dipole moment excited-state C153 by ethanol at the expense of hydrogen-bonding with the pore. It is shown that a change in molecule location resulting from shifts in the charge distribution is a general result, though how the solute position changes will depend upon the specific system. This has important implications for interpreting measurements and designing applications of mesoporous materials.
Pseudorapidity Distribution of Charged Particles in d+Au Collisions at √(sNN)=200 GeV
Back, B. B.; Baker, M. D.; Ballintijn, M.; Barton, D. S.; Becker, B.; Betts, R. R.; Bickley, A. A.; Bindel, R.; Busza, W.; Carroll, A.; Decowski, M. P.; García, E.; Gburek, T.; George, N.; Gulbrandsen, K.; Gushue, S.; Halliwell, C.; Hamblen, J.; Harrington, A. S.; Henderson, C.; Hofman, D. J.; Hollis, R. S.; Hołyński, R.; Holzman, B.; Iordanova, A.; Johnson, E.; Kane, J. L.; Khan, N.; Kulinich, P.; Kuo, C. M.; Lee, J. W.; Lin, W. T.; Manly, S.; Mignerey, A. C.; Nouicer, R.; Olszewski, A.; Pak, R.; Park, I. C.; Pernegger, H.; Reed, C.; Roland, C.; Roland, G.; Sagerer, J.; Sarin, P.; Sedykh, I.; Skulski, W.; Smith, C. E.; Steinberg, P.; Stephans, G. S.; Sukhanov, A.; Tonjes, M. B.; Trzupek, A.; Vale, C.; van Nieuwenhuizen, G. J.; Verdier, R.; Veres, G. I.; Wolfs, F. L.; Wosiek, B.; Woźniak, K.; Wysłouch, B.; Zhang, J.
2004-08-01
The measured pseudorapidity distribution of primary charged particles in minimum-bias d+Au collisions at √(sNN)=200 GeV is presented for the first time. This distribution falls off less rapidly in the gold direction as compared to the deuteron direction. The average value of the charged particle pseudorapidity density at midrapidity is ∣η∣≤0.6=9.4±0.7(syst) and the integrated primary charged particle multiplicity in the measured region is 82±6(syst). Estimates of the total charged particle production, based on extrapolations outside the measured pseudorapidity region, are also presented. The pseudorapidity distribution, normalized to the number of participants in d+Au collisions, is compared to those of Au+Au and p+p¯ systems at the same energy. The d+Au distribution is also compared to the predictions of the parton saturation model, as well as microscopic models.
A Numerical Model for Ion Charge Distribution of Plasmas in Collisional Radiative Steady State
Institute of Scientific and Technical Information of China (English)
DUAN Yaoyong; GUO Yonghui; QIU Aici; KUAI Bin
2009-01-01
A numerical model for the charge state distribution of plasmas in a collisional ra-diative steady state (CRSS) is established by averaging over the atomic process rate coefficients in universal kinetic equations.It is used to calculate the mean ion charge and ion population for a given temperature and density of the plasmas,ranging from low Z to high Z elements.The comparisons of the calculated results with those of other non-local thermodynamic equilibrium kinetics codes show that this model possesses acceptable precision.Furthermore,the NLTE effects are investigated by virtue of the model,and the differences between CRSS and LTE models for low density plasmas are quite evident.
Charge distribution dependency on gap thickness of CMS endcap RPC
Park, Sung Keun
2016-01-01
We present a systematic study of charge distribution dependency of CMS Resistive Plate Chamber (RPC) on gap thickness.Prototypes of double-gap with five different gap thickness from 1.8mm to 1.0mm in 0.2mm steps have been built with 2mm thick phenolic high-pressure-laminated (HPL) plates. The charges of cosmic-muon signals induced on the detector strips are measured as a function of time using two four-channel 400-MHz fresh ADCs. In addition, the arrival time of the muons and the strip cluster sizes are measured by digitizing the signal using a 32-channel voltage-mode front-end-electronics and a 400-MHz 64-channel multi-hit TDC. The gain and the input impedance of the front-end-electronics were 200mV/mV and 20 Ohm, respectively.
The nomogram of density distribution of lunar craters.
Pugacheva, S. G.; Bolkhovitinov, I. S.
1994-12-01
Least-square fits to the density of the distribution of lunar craters described by the approximating function are found for craters larger then 10 km in diamater. The nomogram of parameters of the approximating function is given for the estimate of density of primary, secondary and tertiary craters over an area of 104km2.
Finite temperature bosonic charge and current densities in compactified cosmic string spacetime
Mohammadi, A.; Bezerra de Mello, E. R.
2016-06-01
In this paper, we study the expectation values of the induced charge and current densities for a massive bosonic field with nonzero chemical potential in the geometry of a higher-dimensional compactified cosmic string with magnetic fluxes along the string core and also enclosed by the compactified direction in thermal equilibrium at finite temperature T . These densities are calculated by decomposing them into the vacuum expectation values and finite temperature contributions coming from the particles and antiparticles. The only nonzero components correspond to the charge, azimuthal, and axial current densities. By using the Abel-Plana formula, we decompose the components of the densities into the part induced by the cosmic string and the one by the compactification. The charge density is an odd function of the chemical potential and even periodic function of the magnetic flux with a period equal to the quantum flux. Moreover, the azimuthal (axial) current density is an even function of the chemical potential and an odd (even) periodic function of the magnetic flux with the same period. In this paper, our main concern is the thermal effect on the charge and current densities, including some limiting cases, the low- and high-temperature approximations. We show that in all cases, the temperature enhances the induced densities.
d-Density Wave Scenario Description of the New Hidden Charge Order in Cuprates
Makhfudz, Imam
2016-06-01
In this paper, we show that the theory of high Tc superconductivity based on a microscopic model with d-density wave (DDW) scenario in the pseudogap phase is able to reproduce some of the most important features of the recent experimentally discovered hidden charge order in several families of Cuprates. In particular, by computing and comparing energies of charge orders of different modulation directions derived from a full microscopic theory with d-density wave scenario, the axial charge order ϕX(Y) with wavevector {Q} = (Q0,0)((0,Q0)) is shown to be unambiguously energetically more favorable over the diagonal charge order ϕX±Y with wavevector {Q} = (Q0, ± Q0) at least in commensurate limit, to be expected also to hold even to more general incommensurate case, in agreement with experiment. The two types of axial charge order ϕX and ϕY are degenerate by symmetry. We find that within the superconducting background, biaxial (checkerboard) charge order is energetically more favorable than uniaxial (stripe) charge order, and therefore checkerboard axial charge order should be the one observed in experiments, assuming a single domain of charge ordered state on each CuO2 plane.
Nanoscale smoothing and the analysis of interfacial charge and dipolar densities
Energy Technology Data Exchange (ETDEWEB)
Junquera, Javier [Departamento de Ciencias de la Tierra y Fisica de la Materia Condensada, Universidad de Cantabria, Avenida de los Castros s/n, 39005 Santander (Spain); Cohen, Morrel H [Department of Physics and Astronomy, Rutgers University, Piscataway, NJ 08854-8019 (United States); Rabe, Karin M [Department of Physics and Astronomy, Rutgers University, Piscataway, NJ 08854-8019 (United States)
2007-05-30
The interface properties of interest in multilayers include interfacial charge densities, dipole densities, band offsets, and screening lengths, among others. Most such properties are inaccessible to direct measurements, but are key to understanding the physics of the multilayers. They are contained within first-principles electronic structure computations but are buried within the vast amount of quantitative information those computations generate. Thus far, they have been extracted from the numerical data by heuristic nanosmoothing procedures which do not necessarily provide results independent of the smoothing process. In the present paper we develop the theory of nanosmoothing, establishing procedures for both unpolarized and polarized systems which yield interfacial charge and dipole densities and band offsets invariant to the details of the smoothing procedures when the criteria we have established are met. We show also that dipolar charge densities, i.e. the densities of charge transferred across the interface, and screening lengths are not invariant. We illustrate our procedure with a toy model in which real, transversely averaged charge densities are replaced by sums of Gaussians. (topical review)
Charge Distributions in Transverse Coordinate Space and in Impact Parameter Space
Hwang, Dae Sung; Kim, Dong Soo; Kim, Jonghyun
2008-01-01
We study the charge distributions of the valence quarks inside nucleon in the transverse coordinate space, which is conjugate to the transverse momentum space. We compare the results with the charge distributions in the impact parameter space.
Density Functional Theory Approach for Charged Hard Sphere Fluids Confined in Spherical Micro-Cavity
Institute of Scientific and Technical Information of China (English)
KANG Yan-Shuang; WANG Hai-Jun
2009-01-01
Within the framework of the density functional theory for classical fluids,the equilibrium density profiles of charged hard sphere fluid confined in micro-cavity are studied by means of the modified fundamental measure theory.The dimension of micro-cavity,the charge of hard sphere and the applied electric field are found to have significant effects on the density profiles.In particular,it is shown that Coulomb interaction,excluded volume interaction and applied electric Geld play the central role in controlling the aggregated structure of the system.
Revealing dressed quarks via the proton's charge distribution.
Cloët, Ian C; Roberts, Craig D; Thomas, Anthony W
2013-09-01
The proton is arguably the most fundamental of nature's readily detectable building blocks. It is at the heart of every nucleus and has never been observed to decay. It is nevertheless a composite object, defined by its valence-quark content: u+u+d--i.e., two up (u) quarks and one down (d) quark; and the manner by which they influence, inter alia, the distribution of charge and magnetization within this bound state. Much of novelty has recently been learned about these distributions; and it now appears possible that the proton's momentum-space charge distribution possesses a zero. Experiments in the coming decade should answer critical questions posed by this and related advances; we explain how such new information may assist in charting the origin and impact of key emergent phenomena within the strong interaction. Specifically, we show that the possible existence and location of a zero in the proton's electric form factor are a measure of nonperturbative features of the quark-quark interaction in the standard model, with particular sensitivity to the running of the dressed-quark mass.
International Nuclear Information System (INIS)
The CORSIKA simulated showers for H, C and Fe cosmic primaries in 8 energy intervals from 1016 eV to 1018 eV, taking into account the response of KASCADE-Grande detectors, have been used to reconstruct the charged particle density for KASCADE-Grande observations, based on the Linsley lateral distribution function (LDF). Extensive studies have been done to investigate features for energy estimation and mass discrimination of cosmic primaries around 1017 eV. It has been found that the charged particle density distribution of EAS exhibits interesting information for both aspects: at larger distances from shower core, around 500 m - 600 m the charge particle density could be used as energy identifier, and at shorter distances from shower core, around, 100 m - 200 m, it signals the mass of the EAS primary. (author)
Wigner Function of Density Operator for Negative Binomial Distribution
Institute of Scientific and Technical Information of China (English)
HE Min-Hua; XU Xing-Lei; ZHANG Duan-Ming; LI Hong-Qi; PAN Gui-Jun; YIN Yan-Ping; CHEN Zhi-Yuan
2008-01-01
By using the technique of integration within an ordered product (IWOP) of operator we derive Wigner function of density operator for negative binomial distribution of radiation field in the mixed state case, then we derive the Wigner function of squeezed number state, which yields negative binomial distribution by virtue of the entangled state representation and the entangled Wigner operator.
International Nuclear Information System (INIS)
An analytical model for surrounding gate metal—oxide—semiconductor field effect transistors (MOSFETs) considering quantum effects is presented. To achieve this goal, we have used a variational approach for solving the Poissonand Schrodinger equations. This model is developed to provide an analytical expression for the inversion charge distribution function for all regions of the device operation. This expression is used to calculate the other important parameters like the inversion charge centroid, threshold voltage and inversion charge density. The calculated expressions for the above parameters are simple and accurate. The validity of this model was checked for the devices with different device dimensions and bias voltages. The calculated results are compared with the simulation results and they show good agreement. (semiconductor devices)
A numerical study on charged-particle scattering and radiography of a steep density gradient
Shao, Guangchao; Wang, Xiaofang
2016-09-01
Electron and proton radiography of polystyrene planar targets with different density gradients is studied by Monte Carlo simulations in a regime that the incident charged-particle's kinetic energy is much higher than its energy loss in the targets. It is shown that by scattering of the electrons or protons, the density gradient causes modulations of the charged-particle beam transmitted from the target and the modulation contrast is sensitive only to a steep gradient, which suggests a novel diagnostic method wherein a steep density gradient could be distinguished from the scattering of a charged-particle beam in radiography. By using a 100-MeV charged-particle beam, it is found that the modulation is evident for a steep density gradient of width smaller than 1 μm for electron radiography and 0.6 μm for proton radiography, respectively, but almost negligible when the density gradient width is greater than 1 μm. The feasibility of diagnosing the steep density gradients in compressed matter is confirmed by the simulations of radiographing a laser-ablated planar foil. Simulations also show that it is possible to diagnose the density gradients inside a multilayered spherical capsule.
Effects of High Charge Densities in Multi-GEM Detectors
Franchino, S; Hall-Wilton, R.; Muller, H.; Oliveri, E.; Pfeiffer, D.; Resnati, F.; Ropelewski, L.; Van Stenis, M.; Streli, C.; Thuiner, P.; Veenhof, R.
2015-01-01
A comprehensive study, supported by systematic measurements and numerical computations, of the intrinsic limits of multi-GEM detectors when exposed to very high particle fluxes or operated at very large gains is presented. The observed variations of the gain, of the ion back-flow, and of the pulse height spectra are explained in terms of the effects of the spatial distribution of positive ions and their movement throughout the amplification structure. The intrinsic dynamic character of the processes involved imposes the use of a non-standard simulation tool for the interpretation of the measurements. Computations done with a Finite Element Analysis software reproduce the observed behaviour of the detector. The impact of this detailed description of the detector in extreme conditions is multiple: it clarifies some detector behaviours already observed, it helps in defining intrinsic limits of the GEM technology, and it suggests ways to extend them.
Papoulia, A; Ekman, J
2016-01-01
Background: Atomic spectral lines from different isotopes display a small shift in energy, commonly referred to as the line isotope shift. One of the components of the isotope shift is the field shift, which depends on the extent and the shape of the nuclear charge density distribution. Purpose: To investigate how sensitive field shifts are with respect to variations in the nuclear size and shape and what information of nuclear charge distributions that can be extracted from measured field shifts. Methods: Nuclear properties are obtained from nuclear density functional theory calculations based on the Skyrme-Hartree-Fock-Bogoliubov approach. These results are combined with multiconfiguration Dirac-Hartree-Fock methods to obtain realistic field shifts. Results: Phenomena such as nuclear deformation and variations in the diffuseness of nuclear charge distributions give measurable contributions to the field shifts. Using a novel approach, we demonstrate the possibility to extract new information concerning the n...
Low Density Phases in a Uniformly Charged Liquid
Knüpfer, Hans; Muratov, Cyrill B.; Novaga, Matteo
2016-07-01
This paper is concerned with the macroscopic behavior of global energy minimizers in the three-dimensional sharp interface unscreened Ohta-Kawasaki model of diblock copolymer melts. This model is also referred to as the nuclear liquid drop model in the studies of the structure of highly compressed nuclear matter found in the crust of neutron stars, and, more broadly, is a paradigm for energy-driven pattern forming systems in which spatial order arises as a result of the competition of short-range attractive and long-range repulsive forces. Here we investigate the large volume behavior of minimizers in the low volume fraction regime, in which one expects the formation of a periodic lattice of small droplets of the minority phase in a sea of the majority phase. Under periodic boundary conditions, we prove that the considered energy {Γ}-converges to an energy functional of the limit "homogenized" measure associated with the minority phase consisting of a local linear term and a non-local quadratic term mediated by the Coulomb kernel. As a consequence, asymptotically the mass of the minority phase in a minimizer spreads uniformly across the domain. Similarly, the energy spreads uniformly across the domain as well, with the limit energy density minimizing the energy of a single droplet per unit volume. Finally, we prove that in the macroscopic limit the connected components of the minimizers have volumes and diameters that are bounded above and below by universal constants, and that most of them converge to the minimizers of the energy divided by volume for the whole space problem.
Zirnstein, E. J.; McComas, D. J.
2015-12-01
Kappa functions have long been used in the analysis and modeling of suprathermal particles in various space plasmas. In situ observations of the supersonic solar wind show its distribution contains a cold ion core and power-law tail, which is well-represented by a kappa function. In situ plasma observations by Voyager, as well as observations of energetic neutral atom (ENA) spectra by the Interstellar Boundary Explorer (IBEX), showed that the compressed and heated inner heliosheath (IHS) plasma beyond the termination shock can also be represented by a kappa function. IBEX exposes the IHS plasma properties through the detection of ENAs generated by charge-exchange in the IHS. However, charge-exchange modifies the plasma as it flows through the IHS, and makes it difficult to ascertain the parent proton distribution. In this paper we investigate the evolution of proton distributions, initially represented by a kappa function, that experience losses due to charge-exchange in the IHS. In the absence of other processes, it is no longer representable by a single kappa function due to the energy-dependent, charge-exchange process. While one can still fit a kappa function to the evolving proton distribution over limited energy ranges, this yields fitting parameters (pseudo-density, pseudo-temperature, pseudo-kappa index) that depend on the energy range of the fit. We discuss the effects of fitting a kappa function to the IHS proton distribution over limited energy ranges, its dependence on the initial proton distribution properties at the termination shock, and implications for understanding the observations.
Drivotin, O. I.; Ovsyannikov, D. A.
2016-09-01
A review of analytical solutions of the Vlasov equation for a beam of charged particles is given. These results are analyzed on the basis of a unified approach developed by the authors. In the context of this method, a space of integrals of motion is introduced in which the integrals of motion of particles are considered as coordinates. In this case, specifying a self-consistent distribution is reduced to defining a distribution density in this space. This approach allows us to simplify the construction and analysis of different self-consistent distributions. In particular, it is possible, in some cases, to derive new solutions by considering linear combinations of well-known solutions. This approach also makes it possible in many cases to give a visual geometric representation of self-consistent distributions in the space of integrals of motion.
Electroosmotic transport in polyelectrolyte-grafted nanochannels with pH-dependent charge density
Chen, Guang; Das, Siddhartha
2015-05-01
"Smart" polyelectrolyte-grafted or "soft" nanochannels with pH-responsiveness have shown great promise for applications like manipulation of ion transport, ion sensing and selection, current rectification, and many more. In this paper, we develop a theory to study the electroosmotic transport in a polyelectrolyte-grafted (or soft) nanochannel with pH-dependent charge density. In one of our recent studies, we have identified that explicit consideration of hydrogen ion concentration is mandatory for appropriately describing the electrostatics of such systems and the resulting monomer concentration must obey a non-unique, cubic distribution. Here, we use this electrostatic calculation to study the corresponding electroosmotic transport. We establish that the effect of pH in the electroosmotic transport in polyelectrolyte-grafted nanochannels introduces two separate issues: first is the consideration of the hydrogen and hydroxyl ion concentrations in describing the electroosmotic body force, and second is the consideration of the appropriate drag force that bears the signature of this cubic monomeric distribution. Our results indicate that the strength of the electroosmotic velocity for the pH-dependent case is always smaller than that for the pH-independent case, with the extent of this difference being a function of the system parameters. Such nature of the electroosmotic transport will be extremely significant in suppressing the electroosmotic flow strength with implications in large number applications such as capillary electrophoresis induced separation, electric field mediated DNA elongation, electrophoretic DNA nanopore sequencing, and many more.
Estimation of current density distribution under electrodes for external defibrillation
Directory of Open Access Journals (Sweden)
Papazov Sava P
2002-12-01
Full Text Available Abstract Background Transthoracic defibrillation is the most common life-saving technique for the restoration of the heart rhythm of cardiac arrest victims. The procedure requires adequate application of large electrodes on the patient chest, to ensure low-resistance electrical contact. The current density distribution under the electrodes is non-uniform, leading to muscle contraction and pain, or risks of burning. The recent introduction of automatic external defibrillators and even wearable defibrillators, presents new demanding requirements for the structure of electrodes. Method and Results Using the pseudo-elliptic differential equation of Laplace type with appropriate boundary conditions and applying finite element method modeling, electrodes of various shapes and structure were studied. The non-uniformity of the current density distribution was shown to be moderately improved by adding a low resistivity layer between the metal and tissue and by a ring around the electrode perimeter. The inclusion of openings in long-term wearable electrodes additionally disturbs the current density profile. However, a number of small-size perforations may result in acceptable current density distribution. Conclusion The current density distribution non-uniformity of circular electrodes is about 30% less than that of square-shaped electrodes. The use of an interface layer of intermediate resistivity, comparable to that of the underlying tissues, and a high-resistivity perimeter ring, can further improve the distribution. The inclusion of skin aeration openings disturbs the current paths, but an appropriate selection of number and size provides a reasonable compromise.
Zhou Dai Mei; Sá Ben-Hao; Li Zhong Dao
2002-01-01
Using a hadron and string cascade model, JPCIAE, and the corresponding Monte Carlo events generator, the energy and centrality dependences of charged particle pseudorapidity density in relativistic nuclear collisions were studied. Within the framework of this model, both the relativistic p anti p experimental data and the PHOBOS and PHENIX Au + Au data could be reproduced fairly well without retuning the model parameters. The author shows that since is not a well defined physical variable both experimentally and theoretically, the charged particle pseudorapidity density per participant pair can increase and also can decrease with increasing of , so it may be hard to use charged particle pseudorapidity density per participant pair as a function of to distinguish various theoretical models for particle production
Snapshots of cooperative atomic motions in the optical suppression of charge density waves.
Eichberger, Maximilian; Schäfer, Hanjo; Krumova, Marina; Beyer, Markus; Demsar, Jure; Berger, Helmuth; Moriena, Gustavo; Sciaini, Germán; Miller, R J Dwayne
2010-12-01
Macroscopic quantum phenomena such as high-temperature superconductivity, colossal magnetoresistance, ferrimagnetism and ferromagnetism arise from a delicate balance of different interactions among electrons, phonons and spins on the nanoscale. The study of the interplay among these various degrees of freedom in strongly coupled electron-lattice systems is thus crucial to their understanding and for optimizing their properties. Charge-density-wave (CDW) materials, with their inherent modulation of the electron density and associated periodic lattice distortion, represent ideal model systems for the study of such highly cooperative phenomena. With femtosecond time-resolved techniques, it is possible to observe these interactions directly by abruptly perturbing the electronic distribution while keeping track of energy relaxation pathways and coupling strengths among the different subsystems. Numerous time-resolved experiments have been performed on CDWs, probing the dynamics of the electronic subsystem. However, the dynamics of the periodic lattice distortion have been only indirectly inferred. Here we provide direct atomic-level information on the structural dynamics by using femtosecond electron diffraction to study the quasi two-dimensional CDW system 1T-TaS(2). Effectively, we have directly observed the atomic motions that result from the optically induced change in the electronic spatial distribution. The periodic lattice distortion, which has an amplitude of ∼0.1 Å, is suppressed by about 20% on a timescale (∼250 femtoseconds) comparable to half the period of the corresponding collective mode. These highly cooperative, electronically driven atomic motions are accompanied by a rapid electron-phonon energy transfer (∼350 femtoseconds) and are followed by fast recovery of the CDW (∼4 picoseconds). The degree of cooperativity in the observed structural dynamics is remarkable and illustrates the importance of obtaining atomic-level perspectives of the
Density Distributions in TATB Prepared by Various Methods
Energy Technology Data Exchange (ETDEWEB)
Hoffman, D M; Fontes, A T
2008-05-13
The density distribution of two legacy types of 1,3,5-triamino-2,4,6-trinitrobenzene (TATB) particles were compared with TATB synthesized by new routes and recrystallized in several different solvents using a density gradient technique. Legacy wet (WA) and dry aminated (DA) TATB crystalline aggregates gave average densities of 1.9157 and 1.9163 g/cc, respectively. Since the theoretical maximum density (TMD) for a perfect crystal is 1.937 g/cc, legacy TATB crystals averaged 99% of TMD or about 1% voids. TATB synthesized from phloroglucinol (P) had comparable particle size to legacy TATBs, but significantly lower density, 1.8340 g/cc. TATB synthesized from 3,5 dibromoanisole (BA) was very difficult to measure because it contained extremely fine particles, but had an average density of 1.8043 g/cc over a very broad range. Density distributions of TATB recrystallized from dimethylsulfoxide (DMSO), sulfolane, and an 80/20 mixture of DMSO with the ionic liquid 1-ethyl-3-methyl- imidazolium acetate (EMImOAc), with some exceptions, gave average densities comparable or better than the legacy TATBs.
The self-energy of a charged particle in the presence of a topological defect distribution
De Carvalho, A M M; Furtado, C; Moraes, Fernando; Furtado, Claudio
2004-01-01
In this work we study a charged particle in the presence of both a continuous distribution of disclinations and a continuous distribution of edge dislocations in the framework of the geometrical theory of defects. We obtain the self-energy for a single charge both in the internal and external regions of either distribution. For both distributions the result outside the defect distribution is the self-energy that a single charge experiments in the presence of a single defect.
Trapped charge densities in Al2O3-based silicon surface passivation layers
Jordan, Paul M.; Simon, Daniel K.; Mikolajick, Thomas; Dirnstorfer, Ingo
2016-06-01
In Al2O3-based passivation layers, the formation of fixed charges and trap sites can be strongly influenced by small modifications in the stack layout. Fixed and trapped charge densities are characterized with capacitance voltage profiling and trap spectroscopy by charge injection and sensing, respectively. Al2O3 layers are grown by atomic layer deposition with very thin (˜1 nm) SiO2 or HfO2 interlayers or interface layers. In SiO2/Al2O3 and HfO2/Al2O3 stacks, both fixed charges and trap sites are reduced by at least a factor of 5 compared with the value measured in pure Al2O3. In Al2O3/SiO2/Al2O3 or Al2O3/HfO2/Al2O3 stacks, very high total charge densities of up to 9 × 1012 cm-2 are achieved. These charge densities are described as functions of electrical stress voltage, time, and the Al2O3 layer thickness between silicon and the HfO2 or the SiO2 interlayer. Despite the strong variation of trap sites, all stacks reach very good effective carrier lifetimes of up to 8 and 20 ms on p- and n-type silicon substrates, respectively. Controlling the trap sites in Al2O3 layers opens the possibility to engineer the field-effect passivation in the solar cells.
X-ray diffraction studies of charge density waves in cuprate superconductors: A brief review
Energy Technology Data Exchange (ETDEWEB)
Blackburn, E., E-mail: e.blackburn@bham.ac.uk
2015-03-01
High temperature superconductivity in the cuprates has fascinated scientists for more than 25 years, but there is still no consensus on the pairing mechanism. Soon after the discovery of high temperature superconductivity, it was suggested that the cuprates have an incipient tendency towards spatial electronic order – spin and charge order. In this paper, I will review X-ray diffraction studies of charge density waves in the cuprates. These results, by a number of different groups, indicate that short-range charge correlations exist across the cuprate family, and in many cases are clearly competing with the superconductivity.
Density distribution in a heavy-medium cyclone
Institute of Scientific and Technical Information of China (English)
Wang Yuling; Zhao Yuemin; Yang Jianguo
2011-01-01
Heavy-medium cyclones are widely used to upgrade run-of-mine coal. But the understanding of flow in a cyclone containing a dense medium is still incomplete. By introducing turbulent diffusion into calculations of centrifugal settling a theoretical distribution function giving the density field can be deduced. Qualitative analysis of the density field in every part of a cylindrical cyclone suggests an optimum design that has exhibited good separation effectiveness and anti-wear performance when in commercial operation.
Energy Technology Data Exchange (ETDEWEB)
Clarke, Tracey M.; Shoaee, Safa; Soon, Ying W.; Durrant, James R. [Centre for Plastic Electronics, Department of Chemistry, Imperial College London, Exhibition Road, London SW7 2AZ (United Kingdom); Ballantyne, Amy; Nelson, Jenny [Centre for Plastic Electronics, Department of Physics, Imperial College London, Exhibition Road, London SW7 2AZ (United Kingdom); Duffy, Warren; Heeney, Martin; McCulloch, Iain [Centre for Plastic Electronics, Department of Chemistry, Imperial College London, Exhibition Road, London SW7 2AZ (United Kingdom); Merck Chemicals, Chilworth Science Park, Southampton SO16 7QD (United Kingdom)
2010-12-07
Charge photogeneration: The correlation between the efficiency of photogeneration of dissociated polarons and photocurrent densities for organic solar cells based on polymer:fullerene blend films is investigated. Optical assays of polaron yield measured in films without electrodes show a remarkably clear correlation with short circuit density and quantum yield measured in complete devices. For the blend films studied herein, the primary determinant of photocurrent generation is the efficiency of dissociation of photogenerated charges away from the polymer/fullerene interface and the primary loss pathway is geminate recombination. (Copyright copyright 2010 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)
Spatially separated charge densities of electrons and holes in organic-inorganic halide perovskites
International Nuclear Information System (INIS)
Solution-processable methylammonium lead trihalide perovskites exhibit remarkable high-absorption and low-loss properties for solar energy conversion. Calculation from density functional theory indicates the presence of non-equivalent halogen atoms in the unit cell because of the specific orientation of the organic cation. Considering the 〈100〉 orientation as an example, I1, one of the halogen atoms, differs from the other iodine atoms (I2 and I3) in terms of its interaction with the organic cation. The valance-band-maximum (VBM) and conduction-band-minimum (CBM) states are derived mainly from 5p orbital of I1 atom and 6p orbital of Pb atom, respectively. The spatially separated charge densities of the electrons and holes justify the low recombination rate of the pure iodide perovskite. Chlorine substitution further strengthens the unique position of the I1 atom, leading to more localized charge density around the I1 atom and less charge density around the other atoms at the VBM state. The less overlap of charge densities between the VBM and CBM states explains the relatively lower carrier recombination rate of the iodine-chlorine mixed perovskite. Chlorine substitution significantly reduces the effective mass at a direction perpendicular to the Pb-Cl bond and organic axis, enhancing the carrier transport property of the mixed perovskite in this direction
Spatially separated charge densities of electrons and holes in organic-inorganic halide perovskites
Energy Technology Data Exchange (ETDEWEB)
Li, Dan; Liang, Chunjun, E-mail: chjliang@bjtu.edu.cn, E-mail: zhqhe@bjtu.edu.cn; Zhang, Huimin; You, Fangtian; He, Zhiqun, E-mail: chjliang@bjtu.edu.cn, E-mail: zhqhe@bjtu.edu.cn [Key Laboratory of Luminescence and Optical Information, Ministry of Education, School of Science, Beijing Jiaotong University, Beijing 100044 (China); Zhang, Chunxiu [Information Recording Materials Lab, Beijing Institute of Graphic Communication, Beijing 102600 (China)
2015-02-21
Solution-processable methylammonium lead trihalide perovskites exhibit remarkable high-absorption and low-loss properties for solar energy conversion. Calculation from density functional theory indicates the presence of non-equivalent halogen atoms in the unit cell because of the specific orientation of the organic cation. Considering the 〈100〉 orientation as an example, I{sub 1}, one of the halogen atoms, differs from the other iodine atoms (I{sub 2} and I{sub 3}) in terms of its interaction with the organic cation. The valance-band-maximum (VBM) and conduction-band-minimum (CBM) states are derived mainly from 5p orbital of I{sub 1} atom and 6p orbital of Pb atom, respectively. The spatially separated charge densities of the electrons and holes justify the low recombination rate of the pure iodide perovskite. Chlorine substitution further strengthens the unique position of the I{sub 1} atom, leading to more localized charge density around the I{sub 1} atom and less charge density around the other atoms at the VBM state. The less overlap of charge densities between the VBM and CBM states explains the relatively lower carrier recombination rate of the iodine-chlorine mixed perovskite. Chlorine substitution significantly reduces the effective mass at a direction perpendicular to the Pb-Cl bond and organic axis, enhancing the carrier transport property of the mixed perovskite in this direction.
Induced fermionic charge and current densities in two-dimensional rings
Bellucci, S; Grigoryan, A Kh
2016-01-01
For a massive quantum fermionic field, we investigate the vacuum expectation values (VEVs) of the charge and current densities induced by an external magnetic flux in a two-dimensional circular ring. Both the irreducible representations of the Clifford algebra are considered. On the ring edges the bag (infinite mass) boundary conditions are imposed for the field operator. This leads to the Casimir type effect on the vacuum characteristics. The radial current vanishes. The charge and the azimuthal current are decomposed into the boundary-free and boundary-induced contributions. Both these contributions are odd periodic functions of the magnetic flux with the period equal to the flux quantum. An important feature that distinguishes the VEVs of the charge and current densities from the VEV of the energy density, is their finiteness on the ring edges. The current density is equal to the charge density for the outer edge and has the opposite sign on the inner edge. The VEVs are peaked near the inner edge and, as f...
Laktionov, Andrey; Chemineau-Chalaye, Emilie; Wesolowski, Tomasz A
2016-08-21
Besides molecular electron densities obtained within the Born-Oppenheimer approximation (ρB(r)) to represent the environment, the ensemble averaged density (〈ρB〉(r)) is also admissible in frozen-density embedding theory (FDET) [Wesolowski, Phys. Rev. A, 2008, 77, 11444]. This makes it possible to introduce an approximation in the evaluation of the solvent effect on quantum mechanical observables consisting of replacing the ensemble averaged observable by the observable evaluated at ensemble averaged ρB(r). This approximation is shown to affect negligibly the solvatochromic shift in the absorption of hydrated acetone. The proposed model provides a continuum type of representation of the solvent, which reflects nevertheless its local structure, and it is to be applied as a post-simulation analysis tool in atomistic level simulations. PMID:26984532
Application of carbon stripping foil to HIRFL-CSR and measurement of charge state distribution
International Nuclear Information System (INIS)
Charged ions may be injected into the CSRm by means of the charge stripping injection or the multiple multi-turn injection. The charge state distribution of the ions passing through the carbon foil has great influence on the performance of the accelerator and thus plays a key role in the charge stripping injection. It's found that the charge state distribution is dependent on the thicknesses of the carbon foil and the energy of the ions. In present work, the carbon stripper was applied to HIRFL-CSR and the best optional charge state distribution was measured. (authors)
Bellucci, S; Bragança, E; Saharian, A A
2016-01-01
We evaluate the fermion condensate and the expectation values of the charge and current densities for a massive fermionic field in (2+1)-dimensional conical spacetime with a magnetic flux located at the cone apex. The consideration is done for both irreducible representations of the Clifford algebra. The expectation values are decomposed into the vacuum expectation values and contributions coming from particles and antiparticles. All these contributions are periodic functions of the magnetic flux with the period equal to the flux quantum. Related to the non-invariance of the model under the parity and time-reversal transformations, the fermion condensate and the charge density have indefinite parity with respect to the change of the signs of the magnetic flux and chemical potential. The expectation value of the radial current density vanishes. The azimuthal current density is the same for both the irreducible representations of the Clifford algebra. It is an odd function of the magnetic flux and an even funct...
Density decrease in vanadium-base alloys irradiated in the dynamic helium charging experiment
Energy Technology Data Exchange (ETDEWEB)
Chung, H.M.; Galvin, T.M.; Smith, D.L. [Argonne National Laboratory, Chicago, IL (United States)
1996-04-01
Combined effects of dynamically charged helium and neutron damage on density decrease (swelling) of V-4Cr-4Ti, V-5Ti, V-3Ti-1Si, and V-8Cr-6Ti alloys have been determined after irradiation to 18-31 dpa at 425-600{degrees}C in the Dynamic helium Charging Experiment (DHCE). To ensure better accuracy in density measurement, broken pieces of tensile specimens {approx} 10 times heavier than a transmission electron microscopy (TEM) disk were used. Density increases of the four alloys irradiated in the DHCE were <0.5%. This small change seems to be consistent with the negligible number density of microcavities characterized by TEM. Most of the dynamically produced helium atoms seem to have been trapped in the grain matrix without significant cavity nucleation or growth.
Dacuña, Javier
2011-11-28
We have developed and have applied a mobility edge model that takes drift and diffusion currents to characterize the space-charge-limited current in organic semiconductors into account. The numerical solution of the drift-diffusion equation allows the utilization of asymmetric contacts to describe the built-in potential within the device. The model has been applied to extract information of the distribution of traps from experimental current-voltage measurements of a rubrene single crystal from Krellner showing excellent agreement across several orders of magnitude in the current. Although the two contacts are made of the same metal, an energy offset of 580 meV between them, ascribed to differences in the deposition techniques (lamination vs evaporation) was essential to correctly interpret the shape of the current-voltage characteristics at low voltage. A band mobility of 0.13cm 2V-1s-1 for holes is estimated, which is consistent with transport along the long axis of the orthorhombic unit cell. The total density of traps deeper than 0.1 eV was 2.2×1016cm -3. The sensitivity analysis and error estimation in the obtained parameters show that it is not possible to accurately resolve the shape of the trap distribution for energies deeper than 0.3 eV or shallower than 0.1 eV above the valence-band edge. The total number of traps deeper than 0.3 eV, however, can be estimated. Contact asymmetry and the diffusion component of the current play an important role in the description of the device at low bias and are required to obtain reliable information about the distribution of deep traps. © 2011 American Physical Society.
Pezeshkian, Weria; Norouzi, Davood; Mohammad-Rafiee, Farshid; Fazli, Hossein
2012-01-01
The distribution of counterions and the electrostatic interaction between two similarly charged dielectric slabs is studied in the strong coupling limit. Dielectric inhomogeneities and discreteness of charge on the slabs have been taken into account. It is found that the amount of dielectric constant difference between the slabs and the environment, and the discreteness of charge on the slabs have opposing effects on the equilibrium distribution of the counterions. At small inter-slab separations, increasing the amount of dielectric constant difference increases the tendency of the counterions toward the middle of the intersurface space between the slabs and the discreteness of charge pushes them to the surfaces of the slabs. In the limit of point charges, independent of the strength of dielectric inhomogeneity, counterions distribute near the surfaces of the slabs. The interaction between the slabs is attractive at low temperatures and its strength increases with the dielectric constant difference. At room t...
Influence of Multiple Ionization on Charge State Distributions
Hahn, Michael; Savin, Daniel Wolf
2015-08-01
The spectrum emitted by a plasma depends on the charge state distribution (CSD) of the gas. For collisionally ionized plasmas, the CSD is is determined by the corresponding rates for electron-impact ionization and recombination. In astrophysics, such plasmas are formed in stars, supernova remnants, galaxies, and galaxy clusters. Current CSD calculations generally do not account for electron-impact multiple ionization (EIMI), a process in which multiple electrons are ejected by a single electron-ion collision. We have estimated the EIMI cross sections for all charge states of iron using a combination of the available experimental data and semi-empirical formulae. We then modeled the CSD and observed the influence of EIMI compared to only including single ionization. One case of interest for astrophysics is nanoflare heating, which is a leading theory to explain the heating of the solar corona. In order to determine whether this theory can indeed explain coronal heating, spectroscopic measurements are being compared to model nanoflare spectra. Such models have attempted to predict the spectra of impulsively heated plasmas in which the CSD is time dependent. These nonequilbirium ionization calculations have so far ignored EIMI, but our findings suggest that EIMI can have a significant effect on the CSD of a nanoflare-heated plasma, changing the ion abundances by up to about 50%.
Mass and charge distributions in Fe-induced reactions
Energy Technology Data Exchange (ETDEWEB)
Madani, H.; Mignerey, A.C.; Marchetti, A.A.; Weston-Dawkes, A.P.; Kehoe, W.L.; Obenshain, F.
1995-02-21
The charge and mass of the projectile-like fragments produced in the 12-MeV/nucleon {sup 56}Fe + {sup 165}Ho reaction were measured at a laboratory scattering angle of 16 degrees. The mass and charge distributions of the projectile-like fragments were generated as a function of total kinetic energy loss (TKEL), and characterized by their neutron and proton centroids and variances, and correlation factors. A weak drift of the system towards mass asymmetry, opposite to the direction which minimizes the potential energy of the composite system, was observed. The increase in the variances with energy loss is consistent with a nucleon exchange mechanism as a means for energy dissipation. Predictions of two nucleon exchange models, Randrup`s and, Tassan-Got`s models, are compared to the experimental results of the 672-MeV {sup 56}Fe + {sup 165}Ho reaction and to other Fe-induced reactions. The proton and neutron centroids were found to be generally better reproduced by Tassan-Got`s model than by Randrup`s model. The variances and correlation factor are well reproduced for asymmetric systems by both models.
Simulation of distribution of radiation energy density in water balls
Institute of Scientific and Technical Information of China (English)
TANG Shi-Biao; MA Qing-Li; YIN Ze-Jie; TANG Yu; HUANG Huan; RAO Nan-Xia; ZHU Da-Ming
2005-01-01
The distribution of energy deposition density in radiate region and its surrounding areas from γ-rays was simulated and analyzed for a water-ball model with Geant4 package ( Geant4.7.0,2005 ) developed by CERN (the Center of European Research of Nucleus). The results show that the distribution depends strongly on the collimating condition of radiation beam. A well-collimated beam would reduce radiation effects on surrounding areas.
Longitudinal Differences of Ionospheric Vertical Density Distribution and Equatorial Electrodynamics
Yizengaw, E.; Zesta, E.; Moldwin, M. B.; Damtie, B.; Mebrahtu, A.; Valledares, C.E.; Pfaff, R. F.
2012-01-01
Accurate estimation of global vertical distribution of ionospheric and plasmaspheric density as a function of local time, season, and magnetic activity is required to improve the operation of space-based navigation and communication systems. The vertical density distribution, especially at low and equatorial latitudes, is governed by the equatorial electrodynamics that produces a vertical driving force. The vertical structure of the equatorial density distribution can be observed by using tomographic reconstruction techniques on ground-based global positioning system (GPS) total electron content (TEC). Similarly, the vertical drift, which is one of the driving mechanisms that govern equatorial electrodynamics and strongly affect the structure and dynamics of the ionosphere in the low/midlatitude region, can be estimated using ground magnetometer observations. We present tomographically reconstructed density distribution and the corresponding vertical drifts at two different longitudes: the East African and west South American sectors. Chains of GPS stations in the east African and west South American longitudinal sectors, covering the equatorial anomaly region of meridian approx. 37 deg and 290 deg E, respectively, are used to reconstruct the vertical density distribution. Similarly, magnetometer sites of African Meridian B-field Education and Research (AMBER) and INTERMAGNET for the east African sector and South American Meridional B-field Array (SAMBA) and Low Latitude Ionospheric Sensor Network (LISN) are used to estimate the vertical drift velocity at two distinct longitudes. The comparison between the reconstructed and Jicamarca Incoherent Scatter Radar (ISR) measured density profiles shows excellent agreement, demonstrating the usefulness of tomographic reconstruction technique in providing the vertical density distribution at different longitudes. Similarly, the comparison between magnetometer estimated vertical drift and other independent drift observation
A High Power Density Three-level Parallel Resonant Converter for Capacitor Charging
Sheng, Honggang
2009-01-01
This dissertation proposes a high-power, high-frequency and high-density three-level parallel resonant converter for capacitor charging. DC-DC pulsed power converters are widely used in military and medical systems, where the power density requirement is often stringent. The primary means for reducing the power converter size has been to reduce loss for reduced cooling systems and to increase the frequency for reduced passive components. Three-level resonant converters, which combine the mer...
Energy Technology Data Exchange (ETDEWEB)
Typel, S.; Wolter, H.H. [Sektion Physik, Univ. Muenchen, Garching (Germany)
1998-06-01
Nuclear matter and ground state properties for (proton and neutron) semi-closed shell nuclei are described in relativistic mean field theory with coupling constants which depend on the vector density. The parametrization of the density dependence for {sigma}-, {omega}- and {rho}-mesons is obtained by fitting to properties of nuclear matter and some finite nuclei. The equation of state for symmetric and asymmetric nuclear matter is discussed. Finite nuclei are described in Hartree approximation, including a charge and an improved center-of-mass correction. Pairing is considered in the BCS approximation. Special attention is directed to the predictions for properties at the neutron and proton driplines, e.g. for separation energies, spin-orbit splittings and density distributions. (orig.)
Formation and Distribution of Space-Charge in Cross-Linked Polyethylene
Institute of Scientific and Technical Information of China (English)
张冶文; 李吉晓; 郑飞虎; 彭宗仁; 吴长顺; 夏钟福
2002-01-01
The formation and distribution of space-charge in a cross-linked polyethylene (XLPE) sample are investigated by means of pressure wave propagation, infrared spectroscopy and electrostatic force microscopy (EFM). The related mechanism of space-charge distribution and the structure of XLPE are discussed. The EFM images show that quite large quantitative space-charges locate at the surface of spherulites.
Energy Technology Data Exchange (ETDEWEB)
Bellucci, S. [INFN, Laboratori Nazionali di Frascati, Frascati (Italy); Bezerra de Mello, E.R. [Universidade Federal da Parai ba, Departamento de Fisica, 58.059-970, Joao Pessoa, PB (Brazil); Braganca, E. [INFN, Laboratori Nazionali di Frascati, Frascati (Italy); Universidade Federal da Parai ba, Departamento de Fisica, 58.059-970, Joao Pessoa, PB (Brazil); Saharian, A.A. [Yerevan State University, Department of Physics, Yerevan (Armenia)
2016-06-15
We evaluate the fermion condensate and the expectation values of the charge and current densities for a massive fermionic field in (2+1)-dimensional conical spacetime with a magnetic flux located at the cone apex. The consideration is done for both irreducible representations of the Clifford algebra. The expectation values are decomposed into the vacuum expectation values and contributions coming from particles and antiparticles. All these contributions are periodic functions of the magnetic flux with the period equal to the flux quantum. Related to the non-invariance of the model under the parity and time-reversal transformations, the fermion condensate and the charge density have indefinite parity with respect to the change of the signs of the magnetic flux and chemical potential. The expectation value of the radial current density vanishes. The azimuthal current density is the same for both the irreducible representations of the Clifford algebra. It is an odd function of the magnetic flux and an even function of the chemical potential. The behavior of the expectation values in various asymptotic regions of the parameters are discussed in detail. In particular, we show that for points near the cone apex the vacuum parts dominate. For a massless field with zero chemical potential the fermion condensate and charge density vanish. Simple expressions are derived for the part in the total charge induced by the planar angle deficit and magnetic flux. Combining the results for separate irreducible representations, we also consider the fermion condensate, charge and current densities in parity and time-reversal symmetric models. Possible applications to graphitic nanocones are discussed. (orig.)
Institute of Scientific and Technical Information of China (English)
张红; 张继彦; 杨向东; 杨国洪; 郑志坚
2003-01-01
A collisional radiative model based on the spin-orbit-split-arrays is used to determine the charge state distribution of gold plasmas. The ab initio atomic structure code of Cowan and the spin-orbit-split-array model were used to calculate all the emission spectra of the different gold species, and a non-local thermodynamic-equilibrium model was coupled to calculate the ion populations at a given plasma density and electron temperature. The charge state distribution and other plasma parameters were determined by comparing the experimental spectra with the theoretical simulated spectra of gold plasmas.
Time-resolved Fermi surface mapping of the charge density wave material DyTe3
Directory of Open Access Journals (Sweden)
Wolf M.
2013-03-01
Full Text Available The femtosecond dynamics of the Fermi surface of DyTe3 and its band structure are investigated by time- and angle-resolved photoemission spectroscopy. We directly monitor the ultrafast collapse of the charge density wave gap within 200 fs.
Equation of state for the detonation products of hexanitrostilbene at various charge densities
Energy Technology Data Exchange (ETDEWEB)
Lee, E. L.; Walton, J. R.; Kramer, P. E.
1976-05-01
An extensive description of the detonation behavior for the unique and useful high explosive hexanitrostilbene (HNS) is presented. To accomplish this the necessary experimental results measured by detonation of the pure material at charge densities of 1.00, 1.20, 1.40, 1.60, and 1.65 (g/cm/sup 3/ = Mg/m/sup 3/) were compiled and evaluated. Estimates of the equation of state of the detonation products were made for each charge density. To confirm these estimates two-dimensional hydrodynamic (HEMP code) calculations to simulate the cylinder test experiments for two charge densities of 1.2 and 1.6 Mg/m/sup 3/ were carried out. Detailed comparisons of the calculational and experimental results were made for these two tests. Interpolation and extrapolation of the equation of state parameters provided final estimates for the other charge densities. The results are summarized in five sets of Chapman-Jouguet parameters and JWL equation of state coefficients.
Scanning tunneling microscopy in TTF-TCNQ: Phase and amplitude modulated charge density waves
DEFF Research Database (Denmark)
Wang, Z.Z.; Gorard, J.C.; Pasquier, C.;
2003-01-01
Charge density waves (CDWs) have been studied at the surface of a cleaved tetrathiafulvalene-tetracyanoquinodimethane (TTF-TCNQ) single crystal using a low temperature scanning tunneling microscope (STM) under ultrahigh-vacuum conditions, between 300 and 33 K with molecular resolution. All CDW...
Lester, Jacob; Chandler, Timothy; Gemene, Kebede L
2015-11-17
We present a simple, rapid, and inexpensive electrochemical sensor based on a reversible pulsed chronopotentiometric polyanion-selective membrane electrode for the detection and quantification of oversulfated chondroitin sulfate (OSCS) and other high charge-density polyanions that could potentially be used to adulterate heparin. The membrane is free of ion exchanger and is formulated with plasticized poly(vinyl chloride) (PVC) and an inert lipophilic salt, tridodecylmethylammonium-dinonylnaphthaline sulfonate (TDMA-DNNS). The neutral salt is used to reduce membrane resistance and to ensure reversibility of the sensor. More importantly, TDMA(+) is used as the recognition element for the polyanions. Here an anodic galvanostatic current pulse is applied across the membrane to cause the extraction of the polyanions from the sample into the membrane and potential is measured at the sample-membrane interface. The measured electromotive force (emf) is proportional to the concentration and the charge density of the polyanions. High charge-density polyanion contaminants and impurities in heparin can be detected using this method since the overall equilibrium potential response of polyions increases with increasing charge density of the polyions. Here, first the potential response of pure heparin is measured at a saturation concentration, the concentration beyond which further addition of heparin does not produce a change in potential response. Then the potential response of heparin tainted with different quantities of the high charge-density contaminant is measured at a fixed total polyion concentration (heparin concentration + contaminant concentration). The latter gives a greater negative potential response due to the presence of the high charge-density contaminant. The increase in the negative potential response can be used for detection and quantification of high charge-density contaminants in heparin. We demonstrate here that 0.3% (w/w) OSCS as well as 0.1% (w
Energy Technology Data Exchange (ETDEWEB)
Fendel, Peter [Thorlabs, 56 Sparta Avenue, Newton, New Jersey 07860 (United States); Ganguly, Biswa N.; Bletzinger, Peter [Air Force Research Laboratory, WPAFB, Ohio 45433 (United States)
2015-08-15
Axial and radial variations of electric field have been measured in dielectric shielded 0.025 m diameter parallel plate electrode with 0.0065 m gap for 1.6 mA, 2260 V helium dc discharge at 1.75 Torr. The axial and radial electric field profiles have been measured from the Stark splitting of 2{sup 1}S→11 {sup 1}P transition through collision induced fluorescence from 4{sup 3}D→2{sup 3}P. The electric field values showed a strong radial variation peaking to 500 kV/m near the cathode radial boundary, and decreasing to about 100 kV/m near the anode edge, suggesting the formation of an obstructed discharge for this low nd condition, where n is the gas density and d is the gap distance. The off-axis Stark spectra showed that the electric field vector deviates from normal to the cathode surface which permits longer path electron trajectories in the inter-electrode gap. Also, the on-axis electric field gradient was very small and off-axis electric field gradient was large indicating a radially non-uniform current density. In order to obtain information about the space charge distribution in this obstructed discharge, it was modeled using the 2-d axisymmetric Poisson solver with the COMSOL finite element modeling program. The best fit to the measured electric field distribution was obtained with a space charge variation of ρ(r) = ρ{sub 0}(r/r{sub 0}){sup 3}, where ρ(r) is the local space charge density, ρ{sub 0} = 6 × 10{sup −3} Coulomb/m{sup 3}, r is the local radial value, and r{sub 0} is the radius of the electrode.
Institute of Scientific and Technical Information of China (English)
无
2000-01-01
Based on the density functional theory and the atom-bond electronegativity equalization model (ABEEM), a method is proposed to construct the softness matrix and to obtain the electron population normal modes (PNMs) for a closed system. Using this method the information about the bond charge polarization in a molecule can be obtained easily. The test calculation shows that the PNM obtained by this method includes all the modes about the bond charge polarization explicitly. And the bond charge polarization mode characterized by the biggest eigenvalue, which is the softest one of all modes related with chemical bonds, can describe the charge polarization process in a molecule as exquisitely as the corresponding ab initio method.
Spatial Distribution of City Tweets and Their Densities
Jiang, Bin; Yin, Junjun; Sandberg, Mats
2016-01-01
Social media outlets such as Twitter constitute valuable data sources for understanding human activities in the virtual world from a geographic perspective. This paper examines spatial distribution of tweets and densities within cities. The cities refer to natural cities that are automatically aggregated from a country's small street blocks, so called city blocks. We adopted street blocks (rather than census tracts) as the basic geographic units and topological center (rather than geometric center) in order to assess how tweets and densities vary from the center to the peripheral border. We found that, within a city from the center to the periphery, the tweets first increase and then decrease, while the densities decrease in general. These increases and decreases fluctuate dramatically, and differ significantly from those if census tracts are used as the basic geographic units. We also found that the decrease of densities from the center to the periphery is less significant, and even disappears, if an arbitra...
Subchondral bone density distribution in the human femoral head
Energy Technology Data Exchange (ETDEWEB)
Wright, David A.; Meguid, Michael; Lubovsky, Omri; Whyne, Cari M. [Sunnybrook Research Institute, Orthopaedic Biomechanics Laboratory, Toronto, Ontario (Canada)
2012-06-15
This study aims to quantitatively characterize the distribution of subchondral bone density across the human femoral head using a computed tomography derived measurement of bone density and a common reference coordinate system. Femoral head surfaces were created bilaterally for 30 patients (14 males, 16 females, mean age 67.2 years) through semi-automatic segmentation of reconstructed CT data and used to map bone density, by shrinking them into the subchondral bone and averaging the greyscale values (linearly related to bone density) within 5 mm of the articular surface. Density maps were then oriented with the center of the head at the origin, the femoral mechanical axis (FMA) aligned with the vertical, and the posterior condylar axis (PCA) aligned with the horizontal. Twelve regions were created by dividing the density maps into three concentric rings at increments of 30 from the horizontal, then splitting into four quadrants along the anterior-posterior and medial-lateral axes. Mean values for each region were compared using repeated measures ANOVA and a Bonferroni post hoc test, and side-to-side correlations were analyzed using a Pearson's correlation. The regions representing the medial side of the femoral head's superior portion were found to have significantly higher densities compared to other regions (p < 0.05). Significant side-to-side correlations were found for all regions (r {sup 2} = 0.81 to r {sup 2} = 0.16), with strong correlations for the highest density regions. Side-to-side differences in measured bone density were seen for two regions in the anterio-lateral portion of the femoral head (p < 0.05). The high correlation found between the left and right sides indicates that this tool may be useful for understanding 'normal' density patterns in hips affected by unilateral pathologies such as avascular necrosis, fracture, developmental dysplasia of the hip, Perthes disease, and slipped capital femoral head epiphysis. (orig.)
Energy Technology Data Exchange (ETDEWEB)
Kowal, Julia; Schulte, Dominik; Sauer, Dirk Uwe [Electrochemical Energy Conversion and Storage Systems Group, Institute for Power Electronics and Electrical Drives (ISEA), RWTH Aachen University, 52066 Aachen (Germany); Karden, Eckhard [Ford Research and Advanced Engineering Europe, Aachen (Germany)
2009-06-01
Measurements show that the dynamic charge acceptance (DCA) of flooded SLI lead-acid batteries during micro-cycling in conventional and micro-hybrid vehicles is strongly dependent on the short-term history, such as previous charge or discharge, current rate, lowest state of charge in the last 24 h and more. Factors of 10 have been reported. Inhomogeneous current distribution, especially as a result of acid stratification, has been suggested to explain the DCA variability. This hypothesis was investigated by simulation of a two-dimensional macrohomogeneous model. It provides a spatial resolution of three elements in horizontal direction in each electrode and three elements in vertical direction. For an existing set of parameters, different current profiles were analyzed with regard to the current distribution during charging and discharging. In these simulations, a strong impact of the short-term history on current, charge and acid density distribution was found as well as a strong influence of micro-cycles on both charge distribution and acid stratification. (author)
Velders, G.J.M.; Feil, D.
1989-01-01
Quantum-chemical density-functional theory (DFT) calculations, using the local-density approximation (LDA), have been performed for hydrogen-bounded silicon clusters to determine the electron density distribution of the Si-Si bond. The density distribution in the bonding region is compared with calc
Ion charge state distributions of vacuum arc plasmas: The origin of species
International Nuclear Information System (INIS)
Vacuum arc plasmas are produced at micrometer-size, nonstationary cathode spots. Ion charge state distributions (CSD close-quote s) are experimentally known for 50 elements, but the theoretical understanding is unsatisfactory. In this paper, CSD close-quote s of vacuum arc plasmas are calculated under the assumption that the spot plasma experiences an instantaneous transition from equilibrium to nonequilibrium while expanding. Observable charge state distributions are the result of a freezing process at this transition. open-quotes Frozenclose quotes CSD close-quote s have been calculated using Saha equations in the Debye-Hueckel approximation of the nonideal plasma for all metals of the Periodic Table and for boron, carbon, silicon, and germanium. The results are presented in a open-quotes periodic table of CSD.close quotes The table contains also the mean ion charge state, the neutral vapor fraction, and the effective plasma temperature and density at the freezing point for each element. The validity of the concepts of open-quotes instantaneous freezingclose quotes and open-quotes effective temperature and densityclose quotes is discussed for low and high currents and for the presence of a magnetic field. Temperature fluctuations have been identified to cause broadening of CSD close-quote s. copyright 1997 The American Physical Society
Extraction of density distributions and particle locations from hologram images
Energy Technology Data Exchange (ETDEWEB)
Okamoto, Koji; Ikeda, Koh; Madarame, Haruki [Tokyo Univ., Tokai, Ibaraki (Japan). Nuclear Engineering Research Lab.
1996-10-01
In this study, the simultaneous measurement technique for three-dimensional density and three-dimensional velocity distributions was evaluated. The Holographic Particle Image Velocimetry (HPIV) was the technique to record the three-dimensional position of the tracer particle on the hologram. When there were density distributions in the interrogation region, the plane optical wave may be modulated because of the difference of the refraction indices. Then, both of the plane wave modulated by density and the spherical wave by particle scatter were interfered with the reference beam, being recorded on the hologram. With reconstructing the hologram, the both of the modulated plane wave and spherical wave were reconstructed. Since the plane wave and spherical wave had low and high frequency, respectively, the two information could be separated using low-pass and high-pass filter. In the experiment, a jet of carbon-dioxide into air with mist were measured. Both mist particle position and the fringe shift caused by the density distribution were well observed, showing the effectiveness of the proposed technique. (author)
Li, Xue; Wu, Guang; Abramov, Yuriy A; Volkov, Anatoliy V; Coppens, Philip
2002-09-17
A combined experimental and theoretical charge density study of the pentapeptide Boc-Gln-d-Iva-Hyp-Ala-Phol (Boc, butoxycarbonyl; Gln, glutamine; Iva, isovaline; Hyp, hydroxyproline; Ala, ethylalanine; Phol, phenylalaninol) is described. The experimental analysis, based on synchrotron x-ray data collected at 20 K, is combined with ab initio theoretical calculations. The topologies of the experimental and theoretical densities are analyzed in terms of the atoms in molecules quantum theory. Topological parameters, including atomic charges and higher moments integrated over the atomic basins, have been evaluated with the program topxd and are used to calculate the electrostatic interactions between the molecules in the crystal. The interaction energies obtained after adding dispersive and repulsive van der Waals contributions agree quite well with those based on M-B3LYP/6-31G** dimer calculations for two of the three dimers in the crystal, whereas for the third a larger stabilization is obtained than predicted by the calculation. The agreement with theory is significantly better than that obtained with multipole moments derived directly from the aspherical atom refinement. The convergence of the interaction as a function of addition of successively higher moments up to and including hexadecapoles (l = 4) is found to be within 2-3 kJ/mol. Although shortcomings of both the theoretical and experimental procedures are pointed out, the agreement obtained supports the potential of the experimental method for the evaluation of interactions in larger biologically relevant molecules. PMID:12221293
Modeling of branching density and branching distribution in low-density polyethylene polymerization
D.M. Kim; P.D. Iedema
2008-01-01
Low-density polyethylene (ldPE) is a general purpose polymer with various applications. By this reason, many publications can be found on the ldPE polymerization modeling. However, scission reaction and branching distribution are only recently considered in the modeling studies due to difficulties i
Chemical bonding in view of electron charge density and kinetic energy density descriptors.
Jacobsen, Heiko
2009-05-01
Stalke's dilemma, stating that different chemical interpretations are obtained when one and the same density is interpreted either by means of natural bond orbital (NBO) and subsequent natural resonance theory (NRT) application or by the quantum theory of atoms in molecules (QTAIM), is reinvestigated. It is shown that within the framework of QTAIM, the question as to whether for a given molecule two atoms are bonded or not is only meaningful in the context of a well-defined reference geometry. The localized-orbital-locator (LOL) is applied to map out patterns in covalent bonding interaction, and produces results that are consistent for a variety of reference geometries. Furthermore, LOL interpretations are in accord with NBO/NRT, and assist in an interpretation in terms of covalent bonding. PMID:19090572
Rak, Zs.; Rost, C. M.; Lim, M.; Sarker, P.; Toher, C.; Curtarolo, S.; Maria, J.-P.; Brenner, D. W.
2016-09-01
Density functional theory calculations were carried out for three entropic rocksalt oxides, (Mg0.1Co0.1Ni0.1Cu0.1Zn0.1)O0.5, termed J14, and J14 + Li and J14 + Sc, to understand the role of charge neutrality and electronic states on their properties, and to probe whether simple expressions may exist that predict stability. The calculations predict that the average lattice constants of the ternary structures provide good approximations to that of the random structures. For J14, Bader charges are transferable between the binary, ternary, and random structures. For J14 + Sc and J14 + Li, average Bader charges in the entropic structures can be estimated from the ternary compositions. Addition of Sc to J14 reduces the majority of Cu, which show large displacements from ideal lattice sites, along with reduction of a few Co and Ni cations. Addition of Li to J14 reduces the lattice constant, consistent with experiment, and oxidizes some of Co as well as some of Ni and Cu. The Bader charges and spin-resolved density of states (DOS) for Co+3 in J14 + Li are very different from Co+2, while for Cu and Ni the Bader charges form continuous distributions and the two DOS are similar for the two oxidation states. Experimental detection of different oxidation states may therefore be challenging for Cu and Ni compared to Co. Based on these results, empirical stability parameters for these entropic oxides may be more complicated than those for non-oxide entropic solids.
Fractional-charge and fractional-spin errors in range-separated density-functional theory
Mussard, Bastien
2016-01-01
We investigate fractional-charge and fractional-spin errors in range-separated density-functional theory. Specifically, we consider the range-separated hybrid (RSH) method which combines long-range Hartree-Fock (HF) exchange with a short-range semilocal exchange-correlation density functional, and the RSH+MP2 method which adds long-range second-order M{{\\o}}ller-Plesset (MP2) correlation. Results on atoms and molecules show that the fractional-charge errors obtained in RSH are much smaller than in the standard Kohn-Sham (KS) scheme applied with semilocal or hybrid approximations, and also generally smaller than in the standard HF method. The RSH+MP2 method tends to have smaller fractional-charge errors than standard MP2 for the most diffuse systems, but larger fractional-charge errors for the more compact systems. Even though the individual contributions to the fractional-spin errors in the H atom coming from the short-range exchange and correlation density-functional approximations are smaller than the corre...
Jung, Ju-Hyun; Kim, Hyun-Chul
2015-01-01
We investigate the medium modification of the generalized vector form factors of the nucleon, which include the electromagnetic and energy-momentum tensor form factors, based on an in-medium modified $\\pi$-$\\rho$-$\\omega$ soliton model. We find that the vector form factors of the nucleon in nuclear matter fall off faster than those in free space, which implies that the charge radii of the nucleon become larger in nuclear medium than in free space. We also compute the corresponding transverse charge densities of the nucleon in nuclear matter, which clearly reveal the increasing of the nucleon size in nuclear medium.
Standard hydrogen electrode and potential of zero charge in density functional calculations
DEFF Research Database (Denmark)
Tripkovic, Vladimir; Björketun, Mårten; Skúlason, Egill;
2011-01-01
Methods to explicitly account for half-cell electrode potentials have recently appeared within the framework of density functional theory. The potential of the electrode relative to the standard hydrogen electrode is typically determined by subtracting the experimental value of the absolute...... functional setups. By analyzing a dozen different water structures, built up from water hexamers, in their uncharged [potential of zero charge (PZC)] states on Pt(111), we then determine three different criteria (no net dipole, no charge transfer, and high water flexibility) that a water structure should...
Kies, R.; Egilsson, T.; Ghibaudo, G.; Pananakakis, G.
1996-06-01
A method for the extraction of the oxide charge density and distribution centroid based on the exploitation of the Fowler plot derivative characteristics is proposed. To this end, the modification of the tunnel transparency due to the presence of charge within the tunneling region is accounted for. Simple analytical formulas which enable the oxide charge density and centroid to be extracted from the maximum Fowler derivative and its electric field position are derived. The comparison with the DiMaria method confirms the overall consistency of the new approach. The impact of negative charge within the oxide on the apparent Fowler barrier height, which can be deduced from the slope of the Fowler plots after uniform gate stress is also analyzed. Finally, it is pointed out that this method permits the oxide trapping properties to be studied even though only one bias polarization can be utilized for the test structure.
Flores, J. C.
2014-08-01
Mesoscopic capacitor theory, which includes intrinsic inductive effects from quantum tunneling, is applied to conducting spherical shells. The zero-point pressure and the number of virtual charged pairs are determined assuming a Poisson distribution. They are completely defined by a dimensionless mesoscopic parameter (χc) measuring the average number of virtual pairs per solid angle and carrying mesoscopic information. Fluctuations remain finite and well defined. Connections with usual quantum-field-theory limit enables us to evaluate χc 1.007110. Equivalently, for a mesoscopic parallel-plate capacitor, the shot noise distribution becomes operative with χc 0.94705 as well being related to the density of virtual pairs. Temperature decoherence and capacitor control are discussed by considering typical values of quantum dot devices and Coulomb blockade theory.
Static and Dynamical Valence-Charge-Density Properties of GaAs
Pietsch, Ullrich
1993-02-01
Owing to the close neighbourhood of Ga and As in Mendeleev's table, GaAs shows two fundamental classes of X-ray structure amplitudes distinguished by their extremely different scattering power. They are differently sensitive to the valence electron density (VED) redistribution caused by the chemical bond and must be measured by different experimental methods. Using such data, both the VED and the difference electron densities (DED) are calculated here. Comparison with theoret-ical densities shows that the VED is characterized by covalent, ionic and metallic contributions. The DED constructed from GaAs and Ge data demonstrates the electronic response caused by a "protonic" charge transfer between both f.c.c. sublattices as well as the transition from a purely covalent to a mixed covalent-ionic bond. Especially the charge-density accumulation between nearest neighbours (bond charge (BC)) depends on the distance between the bonding atoms and changes under the influence of any lattice deformation. This phenomenon is described by a BC-transfer model. Its direct experimental proof is given by measuring the variation of the scattering power of weak reflections under the influence of an external electric field. This experiment demonstrates that the ionicity of the bond changes in addition to the BC variation.
Sensitivity of reaction cross sections to halo nucleus density distributions
Alkhazov, G. D.; Sarantsev, V. V.
2013-01-01
In order to clear up the sensitivity of the nucleus--nucleus reaction cross sections $\\sigma_R$ to the nuclear matter distributions in exotic halo nuclei, we have calculated the values of $\\sigma_R$ for scattering of $^6$He, $^{11}$Li, and $^{19}$C nuclei on several nuclear targets at the energy of 0.8 GeV/nucleon. The calculations were performed in the "rigid target" approximation to the Glauber theory, different shapes of the nuclear density distributions in $^6$He, $^{11}$Li, and $^{19}$C ...
IS THE DENSITY DISTRIBUTION OF CLUSTERS NON-GAUSSIAN ?
Kolatt, Tsafrir
1995-01-01
The one-point probability distribution function (pdf) is computed for the $25\\hmpc$-smoothed density field of rich clusters of galaxies in the Abell/\\aco\\ catalogs. The observed pdf is compared to the pdf s drawn similarly from mock catalogs of clusters in cosmological simulations of Gaussian and several non-Gaussian initial conditions. Several statistics allow significant rejection of the non-Gaussian models tested here, and fail to reject the Gaussian model. A comparison with the prediction...
Carbon density and distribution of six Chinese temperate forests.
Zhang, QuanZhi; Wang, ChuanKuan
2010-07-01
Quantifying forest carbon (C) storage and distribution is important for forest C cycling studies and terrestrial ecosystem modeling. Forest inventory and allometric approaches were used to measure C density and allocation in six representative temperate forests of similar stand age (42-59 years old) and growing under the same climate in northeastern China. The forests were an aspen-birch forest, a hardwood forest, a Korean pine plantation, a Dahurian larch plantation, a mixed deciduous forest, and a Mongolian oak forest. There were no significant differences in the C densities of ecosystem components (except for detritus) although the six forests had varying vegetation compositions and site conditions. However, the differences were significant when the C pools were normalized against stand basal area. The total ecosystem C density varied from 186.9 tC hm(-2) to 349.2 tC hm(-2) across the forests. The C densities of vegetation, detritus, and soil ranged from 86.3-122.7 tC hm(-2), 6.5-10.5 tC hm(-2), and 93.7-220.1 tC hm(-2), respectively, which accounted for 39.7% +/- 7.1% (mean +/- SD), 3.3% +/- 1.1%, and 57.0% +/- 7.9% of the total C densities, respectively. The overstory C pool accounted for > 99% of the total vegetation C pool. The foliage biomass, small root (diameter Mongolian oak forest, in which the small roots tended to be vertically distributed downwards. The C density of coarse woody debris was significantly less in the two plantations than in the four naturally regenerated forests. The variability of C allocation patterns in a specific forest is jointly influenced by vegetation type, management history, and local water and nutrient availability. The study provides important data for developing and validating C cycling models for temperate forests. PMID:20697872
Reinhard, P.-G.; Nazarewicz, W.
2016-05-01
Background: Radii of charge and neutron distributions are fundamental nuclear properties. They depend on both nuclear interaction parameters related to the equation of state of infinite nuclear matter and on quantal shell effects, which are strongly impacted by the presence of nuclear surface. Purpose: In this work, by studying the correlation of charge and neutron radii, and neutron skin, with nuclear matter parameters, we assess different mechanisms that drive nuclear sizes. Method: We apply nuclear density functional theory using a family of Skyrme functionals obtained by means of optimization protocols, which do not include any radius information. By performing the Monte Carlo sampling of reasonable functionals around the optimal parametrization, we scan all correlations between nuclear matter properties and observables characterizing charge and neutron distributions of spherical closed-shell nuclei 48Ca,208Pb, and 298Fl. Results: By considering the influence of various nuclear matter properties on charge and neutron radii in a multidimensional parameter space of Skyrme functionals, we demonstrate the existence of two strong relationships: (i) between the nuclear charge radii and the saturation density of symmetric nuclear matter ρ0, and (ii) between the neutron skins and the slope of the symmetry energy L . The impact of other nuclear matter properties on nuclear radii is weak or nonexistent. For functionals optimized to experimental binding energies only, proton and neutron radii are found to be weakly correlated due to canceling trends from different nuclear matter characteristics. Conclusion: The existence of only two strong relations connecting nuclear radii with nuclear matter properties has important consequences. First, by requiring that the nuclear functional reproduces the empirical saturation point of symmetric nuclear matter practically fixes the charge (or proton) radii, and vice versa. This explains the recent results of ab initio calculations
Specific Heat and Charge Density of Quasi-One-Dimensional Interchain Coupling Organic Ferromagnets
Institute of Scientific and Technical Information of China (English)
WANG Zhong-Long; YAO Kai-Lun
2008-01-01
On the basis of a generalized SSH model, an organic polymer ferromagnet theory is proposed at the finite temperature in the self-consistent mean field approximation, and the specific heat and charge density of the quasi-one-dimensional interchain coupling organic ferromagnets are presented. We find that an obvious feature is to present itself the round peak for the specific heat with the temperature. This indicates unambiguously the presence of the phase transition in the system. The transition temperature plays down with increasing of the interchain coupling t2 or decreasing of the electron repulsion u. The curves of charge density with the temperature debase monotonously. This result illustrates that the higher the temperature is, the more electrons are excited.
Bond length and charge density variations within extended arm chair defects in graphene.
Warner, Jamie H; Lee, Gun-Do; He, Kuang; Robertson, Alex W; Yoon, Euijoon; Kirkland, Angus I
2013-11-26
Extended linear arm chair defects are intentionally fabricated in suspended monolayer graphene using controlled focused electron beam irradiation. The atomic structure is accurately determined using aberration-corrected transmission electron microscopy with monochromation of the electron source to achieve ∼80 pm spatial resolution at an accelerating voltage of 80 kV. We show that the introduction of atomic vacancies in graphene disrupts the uniformity of C-C bond lengths immediately surrounding linear arm chair defects in graphene. The measured changes in C-C bond lengths are related to density functional theory (DFT) calculations of charge density variation and corresponding DFT calculated structural models. We show good correlation between the DFT predicted localized charge depletion and structural models with HRTEM measured bond elongation within the carbon tetragon structure of graphene. Further evidence of bond elongation within graphene defects is obtained from imaging a pair of 5-8-5 divacancies.
Semilocal and Hybrid Density Embedding Calculations of Ground-State Charge-Transfer Complexes
Laricchia, S; Della Sala, F; 10.1063/1.4795825
2013-01-01
We apply the frozen density embedding method, using a full relaxation of embedded densities through a freeze-and-thaw procedure, to study the electronic structure of several benchmark ground-state charge-transfer complexes, in order to assess the merits and limitations of the approach for this class of systems. The calculations are performed using both semilocal and hybrid exchange-correlation (XC) functionals. The results show that embedding calculations using semilocal XC functionals yield rather large deviations with respect to the corresponding supermolecular calculations. Due to a large error cancellation effect, however, they can often provide a relatively good description of the electronic structure of charge-transfer complexes, in contrast to supermolecular calculations performed at the same level of theory. On the contrary, when hybrid XC functionals are employed, both embedding and supermolecular calculations agree very well with each other and with the reference benchmark results. In conclusion, fo...
Exploring effective interactions through transition charge density study of 70,72,74,76Ge nuclei
Indian Academy of Sciences (India)
A Shukla; P K Raina; P K Rath
2005-02-01
Transition charge densities (TCD) for $0^{+} → 2_{1}^{+}$ excitation have been calculated for 70, 72, 74, 76Ge nuclei within microscopic variational framework employing 23/2, 15/2, 21/2 and 19/2 valence space. The calculated TCDs for different monopole variants of Kuo interaction are compared with available experimental results. Other systematics like reduced transition probabilities (2) and static quadrupole moments (2) are also presented. It is observed that the transition density study acts as a sensitive probe for discriminating the response of different parts of effective interactions.
Modeling the potential energy field caused by mass density distribution with Eton approach
Alkahtani, Badr Saad T.; Atangana, Abdon
2016-04-01
A new approach for modeling real world problems called the "Eton Approach" was presented in this paper. The "Eton approach" combines both the concept of the variable order derivative together with Atangana derivative with memory derivative. The Atangana derivative with memory is used to account for the memory and fractional derivative for its filter effect. The approach was used to describe the potential energy field that is caused by a given charge or mass density distribution.We solve the modified model numerically and present supporting numerical simulations.
Oberhofer, H
2009-01-01
We present a plane-wave basis set implementation of charge constrained density functional molecular dynamics (CDFT-MD) for simulation of electron transfer reactions in condensed phase systems. Following earlier work of Wu et al. Phys. Rev. A 72, 024502 (2005), the density functional is minimized under the constraint that the charge difference between donor and acceptor is equal to a given value. The classical ion dynamics is propagated on the Born-Oppenheimer surface of the charge constrained state. We investigate the dependence of the constrained energy and of the energy gap on the definition of the charge, and present expressions for the constraint forces. The method is applied to the Ru2+-Ru3+ electron self-exchange reaction in aqueous solution. Sampling the vertical energy gap along CDFT-MD trajectories, and correcting for finite size effects, a reorganization free energy of 1.6 eV is obtained. This is 0.1-0.2 eV lower than a previous estimate based on a continuum model for solvation. smaller value for re...
Sperber, Bram L. H. M.; Schols, Henk A.; Stuart, Martien A. Cohen; Norde, Willem; Voragen, Alphons G. J.
2009-01-01
The complex formation between beta-lactoglobulin (beta-lg) and pectin is studied using pectins with different physicochemical characteristics. Pectin allows for the control of both the overall charge by degree of methyl-esterification as well as local charge density by the degree of blockiness. Vary
Charge density wave in graphene: magnetic-field-induced Peierls instability
Fuchs, Jean-Noël; Lederer, Pascal
2006-01-01
We suggest that a magnetic-field-induced Peierls instability accounts for the recent experiment of Zhang et al. in which unexpected quantum Hall plateaus were observed at high magnetic fields in graphene on a substrate. This Peierls instability leads to an out-of-plane lattice distortion resulting in a charge density wave (CDW) on sublattices A and B of the graphene honeycomb lattice. We also discuss alternative microscopic scenarios proposed in the literature and leading to a similar CDW gro...
Charge density wave in graphene: magnetic-field-induced Peierls instability
Fuchs, Jean-Noël; Lederer, Pascal
2007-01-01
Proceeding of the "graphene conference" (25 September - 01 October 2006) held in Dresden. We suggest that a magnetic-field-induced Peierls instability accounts for the recent experiment of Zhang et al. in which unexpected quantum Hall plateaus were observed at high magnetic fields in graphene on a substrate. This Peierls instability leads to an out-of-plane lattice distortion resulting in a charge density wave (CDW) on sublattices A and B of the graphene honeycomb lattice. We also discuss ...
Resummed one-loop gluonic contributions to the color superconducting color charge density vanish
Gerhold, Andreas
2004-01-01
It is shown that gluonic corrections to the tadpole diagrams vanish in the 2SC and CFL phases at the order where one might have expected NLO corrections. This implies that the gluonic part of the color charge density is negligible at the order of our computation. This statement remains true after inclusion of the gluon vertex correction and contributions from Nambu-Goldstone bosons.
The malleability of uranium: manipulating the charge-density wave in epitaxial films
Springell, R.; Ward, R. C. C.; Bouchet, J.; Chivall, J.; Wermeille, D.; Normile, P. S.; Langridge, S.; Zochowski, S W; Lander, G. H.
2014-01-01
We report x-ray synchrotron experiments on epitaxial films of uranium, deposited on niobium and tungsten seed layers. Despite similar lattice parameters for these refractory metals, the uranium epitaxial arrangements are different and the strains propagated along the a-axis of the uranium layers are of opposite sign. At low temperatures these changes in epitaxy result in dramatic modifications to the behavior of the charge-density wave in uranium. The differences are explained with the curren...
Nuclear charge-exchange excitations in localized covariant density functional theory
Liang, H Z; Nakatsukasa, T; Niu, Z M; Ring, P; Roca-Maza, X; Van Giai, N; Zhao, P W
2014-01-01
The recent progress in the studies of nuclear charge-exchange excitations with localized covariant density functional theory is briefly presented, by taking the fine structure of spin-dipole excitations in 16O as an example. It is shown that the constraints introduced by the Fock terms of the relativistic Hartree-Fock scheme into the particle-hole residual interactions are straightforward and robust.
Astakhov, O.; Carius, R.; F. Finger; Petrusenko, Y.; Borysenko, V.; Barankov, D.
2009-01-01
The influence of dangling-bond defects and the position of the Fermi level on the charge carrier transport properties in undoped and phosphorous doped thin-film silicon with structure compositions all the way from highly crystalline to amorphous is investigated. The dangling-bond density is varied reproducibly over several orders of magnitude by electron bombardment and subsequent annealing. The defects are investigated by electron-spin-resonance and photoconductivity spectroscopies. Comparin...
Correlation of scanning-tunneling-microscope image profiles and charge-density-wave amplitudes
International Nuclear Information System (INIS)
Scanning-tunneling-microscope (STM) studies of 4Hb-TaS2 and 4Hb-TaSe2 at 4.2 K show systematic correlation between the charge-density-wave (CDW) amplitude and the STM deflection. The 4Hb phases have both weak and strong CDW's in the trigonal prismatic and octahedral sandwiches, respectively. Scans on opposite faces of the same cleave allow a comparison of the STM response to the two types of CDW
Nuclear charge-exchange excitations in localized covariant density functional theory
International Nuclear Information System (INIS)
The recent progress in the studies of nuclear charge-exchange excitations with localized covariant density functional theory is briefly presented, by taking the fine structure of spin-dipole excitations in 16O as an example. It is shown that the constraints introduced by the Fock terms of the relativistic Hartree-Fock scheme into the particle-hole residual interactions are straightforward and robust. (authors)
Three-dimensional density distributions in the Asian lithosphere
Zhang, G.; Li, C.; Wang, X.; Wang, Z.; Fang, J.; Sino-probe-cugb
2011-12-01
We have inversed the residual Bouguer gravity anomalies to study the three-dimensional density distributions of the Asian lithosphere (60°~150°E and 15°~60°N). Firstly, we have collected the free-air gravity anomalies (30'×30') and topography data of GTOP030 with 5'×5' grid spacing, and then calculated the Bougouer gravity anomalies by terrain correction and Bougouer correction. We have also collected the depth data of the Moho discontinuity (30'×30') and the discontinuity of sedimentary layer. By using the Oldenburg-Parker formula (Parker, 1972) and the forward modeling method, we calculated the theoretical gravity anomalies which mainly are caused by the Moho discontinuity and the sedimentary layer discontinuity. In our study, the average depths of Moho discontinuity and sedimentary layer discontinuity are 33 km and 4 km, and the density differences are 0.42 g/cm3 and 0.2 g/cm3, respectively. In addition, we have simulated the gravity anomalies of the spherical harmonics with the 2-6 order for the lower mantle by using the formula of Bowin (1983) which represented the relation between the depth of field source and the order of the geopotential spherical harmonics. Using all data mentioned above, we have calculated the residual Bougouer gravity anomalies, which may be caused by anomalous density bodies in the lithosphere. Secondly, we used the calculated residual Bougouer gravity anomalies to inverse the three-dimensional density differences in the Asian lithosphere by using the Algebra Reconstruction Techniques (ART). During the inversion, the densities converted from the P-wave velocity data (with grid spacing of 2°×2°) according to the Birch Law are considered as the initial density model. The grid spacing is set as 2°×2° in the horizontal direction, and it is 25 km, 55 km and 100 km in the vertical direction, respectively. Comparing the density anomalies at the three depths, we can conclude that (1) the density in the lithosphere beneath Asian
Dielectric sample with two-layer charge distribution for space charge calibration purposes
DEFF Research Database (Denmark)
Holbøll, Joachim; Henriksen, Mogens; Rasmussen, C.
2002-01-01
In the present paper is described a dielectric test sample with two very narrow concentrations of bulk charges, achieved by two internal electrodes not affecting the acoustical properties of the sample, a fact important for optimal application of most space charge measuring systems. Space charge...... formation was investigated under different electrical conditions by means of the laser induced pressure pulse (LIPP) method and the pulsed electro-acoustic method (PEA)....
International Nuclear Information System (INIS)
For an optimal design of ion sources and for some aspects of plasma diagnostics it is important to study the influence of all processes and parameters that are essential for the production and loss of multiply charged ions. Till now all existing calculations of CSD neglected charge transfer because of missing data. Now many of the very big charge transfer cross sections are measured and so we are able to include them into our calculations. (orig.)
Iliadis, Christian; Champagne, Art; Coc, Alain; Fitzgerald, Ryan
2010-01-01
Numerical values of charged-particle thermonuclear reaction rates for nuclei in the A=14 to 40 region are tabulated. The results are obtained using a method, based on Monte Carlo techniques, that has been described in the preceding paper of this series (Paper I). We present a low rate, median rate and high rate which correspond to the 0.16, 0.50 and 0.84 quantiles, respectively, of the cumulative reaction rate distribution. The meaning of these quantities is in general different from the commonly reported, but statistically meaningless expressions, "lower limit", "nominal value" and "upper limit" of the total reaction rate. In addition, we approximate the Monte Carlo probability density function of the total reaction rate by a lognormal distribution and tabulate the lognormal parameters {\\mu} and {\\sigma} at each temperature. We also provide a quantitative measure (Anderson-Darling test statistic) for the reliability of the lognormal approximation. The user can implement the approximate lognormal reaction rat...
DEFF Research Database (Denmark)
Bambery, K.R.; Fleming, R.J.; Holbøll, Joachim
2001-01-01
Laser induced pressure pulse space charge measurements were made on 1.5 mm thick plaques of high purity low density polyethylene equipped with vacuum-evaporated aluminium electrodes. Temperature differences up to 20 °C were maintained across the samples, which were subjected to dc fields up to 1.......5×107 V m-1. Current density was also measured as a function of temperature and field. Space charge due exclusively to the temperature gradient was detected, with density of order 0.01 C m-3. The activation energy associated with the transport of electrons through the bulk was calculated as 0.09 e......V. However, measurements of the temperature dependence of the current in isothermal samples yielded activation energies in the range 0.9-1.3 eV. It is deduced that most of this larger activation energy is associated with charge injection at the electrodes. Electron mobilities not less than 2×10-12 m2 V-1 s-1...
Dong, Xiao-Yan; Chen, Ran; Yang, Chun-Yan; Sun, Yan
2014-06-20
We have previously found that addition of like-charged media in a refolding solution can greatly enhance the refolding of pure proteins by suppressing protein aggregation. Herein, negatively charged mono-sized microspheres with sulfonic groups were fabricated to explore the facilitating effect of like-charged media on the refolding of enhanced green fluorescent protein (EGFP) expressed as inclusion bodies (IBs). A sequential polymer-tentacle grafting and sulfonate modification strategy was developed to increase the charge density of mono-sized poly(glycidyl methacrylate) (pGMA) beads (2.4μm). Namely, GMA was first grafted onto the beads by grafting polymerization to form poly(GMA) tentacles on the pGMA beads, and then the epoxy groups on the tentacles were converted into sulfonic groups by modification with sodium sulfite. By this fabrication strategy, the charge density of the beads reached 793μmol/g, about 2.8 times higher than that modified without prior grafting of the pGMA beads (285μmol/g). The negatively charged beads of different charge densities were used for facilitating the refolding of like-charged EGFP from IBs. The refolding yield as well as refolding rate increased with increasing charge density. The anti-aggregation effects of urea and like-charged microspheres were synergetic. In addition, partial purification of EGFP was achieved because the ion-exchange adsorption led to 52% removal of positively charged contaminant proteins in the refolded solution. Finally, reusability of the tentacle beads was demonstrated by repetitive EGFP refolding and recovery cycles.
Directory of Open Access Journals (Sweden)
Lampert Winfried
2005-04-01
Full Text Available Abstract Background In lakes with a deep-water algal maximum, herbivorous zooplankton are faced with a trade-off between high temperature but low food availability in the surface layers and low temperature but sufficient food in deep layers. It has been suggested that zooplankton (Daphnia faced with this trade-off distribute vertically according to an "Ideal Free Distribution (IFD with Costs". An experiment has been designed to test the density (competition dependence of the vertical distribution as this is a basic assumption of IFD theory. Results Experiments were performed in large, indoor mesocosms (Plankton Towers with a temperature gradient of 10°C and a deep-water algal maximum established below the thermocline. As expected, Daphnia aggregated at the interface between the two different habitats when their density was low. The distribution spread asymmetrically towards the algal maximum when the density increased until 80 % of the population dwelled in the cool, food-rich layers at high densities. Small individuals stayed higher in the water column than large ones, which conformed with the model for unequal competitors. Conclusion The Daphnia distribution mimics the predictions of an IFD with costs model. This concept is useful for the analysis of zooplankton distributions under a large suite of environmental conditions shaping habitat suitability. Fish predation causing diel vertical migrations can be incorporated as additional costs. This is important as the vertical location of grazing zooplankton in a lake affects phytoplankton production and species composition, i.e. ecosystem function.
Distribution of charge carriers in dissipative structure of semiconductors
Kamilov, I K; Kovalev, A S
2002-01-01
It has been shown experimentally that redistribution of the charge carrier concentration takes place in the volume of Te and InSb monocrystals under formation and excitation by the strong field of a dissipative structure in nonequilibrium electron-hole plasma. This leads to a situation when the presence of only longitudinal autosolitons in the dissipative structure reduces the charge carrier concentration outside autosolitons while the presence of only transversal autosolitons makes the charge carriers concentration larger. These effects are explained in the following manner: longitudinal autosolitons, occurring in nonequilibrium electron-hole plasma created by the Joule heating are considered as cold and transversal autosolitons are considered as hot ones
Equilibrium charge state distributions of high energy heavy ions
International Nuclear Information System (INIS)
Equilibrium charge state fractions have been measured for N, O, Ne, S, Ar and Kr ions at 1.04 MeV/nucleon after passing through various stripping materials. Further data were obtained at higher energy for S ions (4.12 MeV/nucleon) and Ar ions (4.12 and 9.6 MeV/nucleon). The mean charge fractions can be fitted to universal curves for both solid and gaseous strippers. Measurements of the equilibrium fraction of krypton ions at 1.04 MeV/nucleon passing through heavy vapours have shown that a higher average charge state is obtained than for lighter gaseous strippers. (Auth.)
Park, Rebecca Sejung; Shulaker, Max Marcel; Hills, Gage; Suriyasena Liyanage, Luckshitha; Lee, Seunghyun; Tang, Alvin; Mitra, Subhasish; Wong, H-S Philip
2016-04-26
We present a measurement technique, which we call the Pulsed Time-Domain Measurement, for characterizing hysteresis in carbon nanotube field-effect transistors, and demonstrate its applicability for a broad range of 1D and 2D nanomaterials beyond carbon nanotubes. The Pulsed Time-Domain Measurement enables the quantification (density, energy level, and spatial distribution) of charged traps responsible for hysteresis. A physics-based model of the charge trapping process for a carbon nanotube field-effect transistor is presented and experimentally validated using the Pulsed Time-Domain Measurement. Leveraging this model, we discover a source of traps (surface traps) unique to devices with low-dimensional channels such as carbon nanotubes and nanowires (beyond interface traps which exist in today's silicon field-effect transistors). The different charge trapping mechanisms for interface traps and surface traps are studied based on their temperature dependencies. Through these advances, we are able to quantify the interface trap density for carbon nanotube field-effect transistors (∼3 × 10(13) cm(-2) eV(-1) near midgap), and compare this against a range of previously studied dielectric/semiconductor interfaces.
Ishizuka, Ryosuke; Matubayasi, Nobuyuki
2016-02-01
A self-consistent scheme is developed to determine the atomic partial charges of ionic liquid. Molecular dynamics (MD) simulation was conducted to sample a set of ion configurations, and these configurations were subject to density functional theory (DFT) calculations to determine the partial charges. The charges were then averaged and used as inputs for the subsequent MD simulation, and MD and DFT calculations were repeated until the MD results are not altered any more. We applied this scheme to 1,3-dimethylimidazolium bis(trifluoromethylsulfonyl) imide ([C1mim][NTf2]) and investigated its structure and dynamics as a function of temperature. At convergence, the average ionic charges were ±0.84 e at 350 K due to charge transfer among ions, where e is the elementary charge, while the reduced ionic charges do not affect strongly the density of [C1mim][NTf2] and radial distribution function. Instead, major effects are found on the energetics and dynamics, with improvements of the overestimated heat of vaporization and the too slow motions of ions observed in MD simulations using commonly used force fields.
Neutron density distribution and neutron skin thickness of $^{208}$Pb
Meucci, Andrea; Giusti, Carlotta; Finelli, Paolo
2014-01-01
We present and discuss numerical predictions for the neutron density distribution of $^{208}$Pb using various non-relativistic and relativistic mean-field models for the nuclear structure. Our results are compared with the very recent pion photoproduction data from Mainz. The parity-violating asymmetry parameter for elastic electron scattering at the kinematics of the PREX experiment at JLab and the neutron skin thickness are compared with the available data. We consider also the dependence between the neutron skin and the parameters of the expansion of the symmetry energy.
Neutron density distribution and neutron skin thickness of Pb208
Meucci, Andrea; Vorabbi, Matteo; Giusti, Carlotta; Finelli, Paolo
2014-08-01
We present and discuss numerical predictions for the neutron density distribution of Pb208 using various nonrelativistic and relativistic mean-field models for the nuclear structure. Our results are compared with the very recent pion photoproduction data from Mainz. The parity-violating asymmetry parameter for elastic electron scattering at the kinematics of the PREX experiment at JLab and the neutron skin thickness are compared with the available data. We consider also the dependence between the neutron skin and the parameters of the expansion of the symmetry energy.
International Nuclear Information System (INIS)
Overlap fermions, which preserve exact chiral symmetry on the lattice, provide a powerful tool for investigating the topological structure of the vacuum. Applying this formulation to zerotemperature quenched SU(3) configurations generated by means of the Luescher-Weisz action, we define the topological charge density with and without UV filtering and study its properties by looking at the density profile and the two-point correlation function. We observe that the density possesses global sign coherent structures, which get increasingly tangled as more and more modes are included. This change of the structure is also detected by the increasing negative tail of the two-point function. We also study the inverse participation ratio of the eigenmodes and discuss their dimensionality. (orig.)
Becker, Maik; Bredemeyer, Niels; Tenhumberg, Nils; Turek, Thomas
2016-03-01
Potential probes are applied to vanadium redox-flow batteries for determination of effective felt resistance and current density distribution. During the measurement of polarization curves in 100 cm2 cells with different carbon felt compression rates, alternating potential steps at cell voltages between 0.6 V and 2.0 V are applied. Polarization curves are recorded at different flow rates and states of charge of the battery. Increasing compression rates lead to lower effective felt resistances and a more uniform resistance distribution. Low flow rates at high or low state of charge result in non-linear current density distribution with high gradients, while high flow rates give rise to a nearly linear behavior.
Haldrup, Sofie; Catalano, Jacopo; Hinge, Mogens; Jensen, Grethe V; Pedersen, Jan S; Bentien, Anders
2016-02-23
The electrokinetic energy conversion (EKEC) of hydraulic work directly into electrical energy has been investigated in charged polymeric membranes with different pore charge densities and characteristic diameters of the nanoporous network. The membranes were synthesized from blends of nitrocellulose and sulfonated polystyrene (SPS) and were comprehensively characterized with respect to structure, composition, and transport properties. It is shown that the SPS can be used as a sacrificial pore generation medium to tune the pore size and membrane porosity, which in turn highly affects the transport properties of the membranes. Furthermore, it is shown that very high EKEC efficiencies (>35%) are encountered in a rather narrow window of the properties of the nanoporous membrane network, that is, with pore diameters of ca. 10 nm and pore charge densities of 4.6 × 10(2) to 1.5 × 10(3) mol SO3(-) m(-3) for dilute solutions (0.03 M LiCl). The high absolute value of the efficiency combined with the determination of the optimal membrane morphology makes membrane-based EKEC devices a step closer to practical applications and high-performance membrane design less empirical.
Lagström, Tove; Gmür, Tobias A; Quaroni, Luca; Goel, Alok; Brown, Matthew A
2015-03-31
We show that attenuated total reflection Fourier-transform infrared (ATR-FTIR) spectroscopy can be used to determine the surface charge density (SCD) of colloidal silica nanoparticles (NPs) in aqueous solution. We identify the Si-O stretch vibrations of neutral surface bound silanol, ≡Si-OH, and of the deprotonated group, ≡Si-O(-). The position of the Si-(OH) stretch vibration is shown to directly correlate with the NPs SCD as determined by traditional potentiometric titrations, shifting to lower wavenumber (cm(-1)) with increasing density of ≡Si-O(-). The origin of this shift is discussed in terms of inductive effects that reduce the ionic character of the Si-(OH) bond after delocalization of the negative charge left on a terminal ≡Si-O(-) group across the atoms within ∼1 nm of the charged site. Using this new methodology, we quantitatively determine the SCD of 9, 14, and 25 nm diameter colloidal silica in varying concentrations of NaCl electrolyte at different bulk pH. This novel spectroscopic approach to investigate SCDs provides several opportunities for in situ coupling, for example, in microfluidic channels or with liquid microjets, and requires only very little sample—all potential advantages over a traditional potentiometric titration. PMID:25761506
Long-range charge-density-wave proximity effect at cuprate/manganate interfaces
Frano, A.; Blanco-Canosa, S.; Schierle, E.; Lu, Y.; Wu, M.; Bluschke, M.; Minola, M.; Christiani, G.; Habermeier, H. U.; Logvenov, G.; Wang, Y.; van Aken, P. A.; Benckiser, E.; Weschke, E.; Le Tacon, M.; Keimer, B.
2016-08-01
The interplay between charge density waves (CDWs) and high-temperature superconductivity is currently under intense investigation. Experimental research on this issue is difficult because CDW formation in bulk copper oxides is strongly influenced by random disorder, and a long-range-ordered CDW state in high magnetic fields is difficult to access with spectroscopic and diffraction probes. Here we use resonant X-ray scattering in zero magnetic field to show that interfaces with the metallic ferromagnet La2/3Ca1/3MnO3 greatly enhance CDW formation in the optimally doped high-temperature superconductor YBa2Cu3O6+δ (δ ~ 1), and that this effect persists over several tens of nanometres. The wavevector of the incommensurate CDW serves as an internal calibration standard of the charge carrier concentration, which allows us to rule out any significant influence of oxygen non-stoichiometry, and to attribute the observed phenomenon to a genuine electronic proximity effect. Long-range proximity effects induced by heterointerfaces thus offer a powerful method to stabilize the charge-density-wave state in the cuprates and, more generally, to manipulate the interplay between different collective phenomena in metal oxides.
Spatial distributions of electron temperature and density in electron cyclotron resonance discharges
International Nuclear Information System (INIS)
Spatial profiles of electron density and temperature of electron cyclotron resonance discharge plasmas have been successfully measured using laser Thomson scattering. The results, thus obtained, were valuable for quantitative comparison with results of a computer simulation. Measurements were performed for two cases with different locations of the electron cyclotron resonance zones. Simulation results obtained from a hybrid code, which treats ions and neutral particles as discrete particles and electrons as a fluid, were fitted to the experimental profiles of the electron density and temperature by adjusting the microwave power deposition profiles. From these comparisons and an analysis of other simulation data, it was found that the large difference of radial electron density profiles for two discharge conditions was caused by the difference of radial space-charge electric-field distributions. The radial electron temperature distribution determined the radial electric field that drove the ions radially and also resulted in a peaked electron density profile for one case and a more uniform profile for the other case. It is also shown that Coulomb collisions of electrons with ions as well as electron endash neutral collisions are important for the analysis of electron behavior along the magnetic field lines. copyright 1997 American Institute of Physics
Growth dynamics, charge density, and structure of polyamide thin-film composite membranes
Matthews, Tamlin
The main objectives of this dissertation are to characterize polyamide layers formed on polysulfone supports, without physical or chemical removal, so that it is close to its native form, which has been used in industrial reverse osmosis applications. Growth dynamics by diffuse reflectance spectroscopy was developed for the polymerization of polyamide on porous polysulfone supports using varying concentrations of m-phenylenediamine (MPD) in water of 0.1-- 100 g/L with a fixed concentration of trimesoyl chloride (TMC) in hexane of 1 g/L, and varying TMC concentrations of 0.1--10 g/L with a fixed MPD concentration of 20 g/L. A relationship was developed between diffuse reflectance and polyamide thickness. The diffuse reflectance data shows that ~50% of the polyamide thickness is produced in 2 g/L. All studied concentrations of TMC at a fixed 20 g/L MPD concentration produced a polyamide thickness of ≈120 nm. Polyamide thickness increases from ≈10 to 110 nm with increasing concentration of MPD at 1 g/L TMC. The roughness measured with AFM increases with increasing MPD concentration but decreases with increasing TMC concentration. At MPD concentrations polyamide does not grow on top of the polysulfone. The charge density of polyamide layers arises from unpolymerized free amine and carboxylic groups contributing positive and negative charges, respectively. The negative charge groups from carboxylic acid were tagged with Ag+. Using the same concentration ranges as the growth dynamics study, the charge densities were characterized in the bulk by RBS and in the near-surface by XPS. With increasing concentration of MPD, the charge density in the near-surface region is constant and ≈0.3 M, due to constant surface contact with the carboxylic acid containing TMC monomer. The charge density decreases from 0.3 M to 0.1 M in the polyamide bulk with increasing MPD concentration. TMC showed a 30x increase in charge density from 0.02 to 0.61 g/L in the bulk polyamide between 0
Differential distribution of Shank and GKAP at the postsynaptic density.
Directory of Open Access Journals (Sweden)
Jung-Hwa Tao-Cheng
Full Text Available Shank and GKAP are scaffold proteins and binding partners at the postsynaptic density (PSD. The distribution and dynamics of Shank and GKAP were studied in dissociated hippocampal cultures by pre-embedding immunogold electron microscopy. Antibodies against epitopes containing their respective mutual binding sites were used to verify the expected juxtapositioning of Shank and GKAP. If all Shank and GKAP molecules at the PSD were bound to each other, the distribution of label for the two proteins should coincide. However, labels for the mutual binding sites showed significant differences in distribution, with a narrow distribution for GKAP located close to the postsynaptic membrane, and a wider distribution for Shank extending deeper into the cytoplasm. Upon depolarization with high K+, neither the intensity nor distribution of label for GKAP changed, but labeling intensity for Shank at the PSD increased to ~150% of controls while the median distance of label from postsynaptic membrane increased by 7.5 nm. These results indicate a preferential recruitment of Shank to more distal parts of the PSD complex. Conversely, upon incubation in Ca2+-free medium containing EGTA, the labeling intensity of Shank at the PSD decreased to ~70% of controls and the median distance of label from postsynaptic membrane decreased by 9 nm, indicating a preferential loss of Shank molecules in more distal parts of the PSD complex. These observations identify two pools of Shank at the PSD complex, one relatively stable pool, closer to the postsynaptic membrane that can bind to GKAP, and another more dynamic pool at a location too far away to bind to GKAP.
Tomographic measurement of the phase space distribution of a space-charge-dominated beam
Stratakis, Diktys
Many applications of accelerators, such as free electron lasers, pulsed neutron sources, and heavy ion fusion, require a good quality beam with high intensity. In practice, the achievable intensity is often limited by the dynamics at the low-energy, space-charge dominated end of the machine. Because low-energy beams can have complex distribution functions, a good understanding of their detailed evolution is needed. To address this issue, we have developed a simple and accurate tomographic method to map the beam phase using quadrupole magnets, which includes the effects from space charge. We extend this technique to use also solenoidal magnets which are commonly used at low energies, especially in photoinjectors, thus making the diagnostic applicable to most machines. We simulate our technique using a particle in cell code (PIC), to ascertain accuracy of the reconstruction. Using this diagnostic we report a number of experiments to study and optimize injection, transport and acceleration of intense space charge dominated beams. We examine phase mixing, by studying the phase-space evolution of an intense beam with a transversely nonuniform initial density distribution. Experimental measurements, theoretical predictions and PIC simulations are in good agreement each other. Finally, we generate a parabolic beam pulse to model those beams from photoinjectors, and combine tomography with fast imaging techniques to investigate the time-sliced parameters of beam current, size, energy spread and transverse emittance. We found significant differences between the slice emittance profiles and slice orientation as the beam propagates downstream. The combined effect of longitudinal nonuniform profiles and fast imaging of the transverse phase space provided us with information about correlations between longitudinal and transverse dynamics that we report within this dissertation.
Evolution of column density distributions within Orion~A
Stutz, A M
2015-01-01
We compare the structure of star-forming molecular clouds in different regions of Orion A to determine how the column density probability distribution function (N-PDF) varies with environmental conditions such as the fraction of young protostars. A correlation between the N-PDF slope and Class 0 protostar fraction has been previously observed in a low-mass star-formation region (Perseus) by Sadavoy; here we test if a similar correlation is observed in a high-mass star-forming region. We use Herschel data to derive a column density map of Orion A. We use the Herschel Orion Protostar Survey catalog for accurate identification and classification of the Orion A young stellar object (YSO) content, including the short-lived Class 0 protostars (with a $\\sim$ 0.14 Myr lifetime). We divide Orion A into eight independent 13.5 pc$^2$ regions; in each region we fit the N-PDF distribution with a power-law, and we measure the fraction of Class 0 protostars. We use a maximum likelihood method to measure the N-PDF power-law ...
Study of Interface Charge Densities for ZrO2 and HfO2 Based Metal-Oxide-Semiconductor Devices
Directory of Open Access Journals (Sweden)
N. P. Maity
2014-01-01
Full Text Available A thickness-dependent interfacial distribution of oxide charges for thin metal oxide semiconductor (MOS structures using high-k materials ZrO2 and HfO2 has been methodically investigated. The interface charge densities are analyzed using capacitance-voltage (C-V method and also conductance (G-V method. It indicates that, by reducing the effective oxide thickness (EOT, the interface charge densities (Dit increases linearly. For the same EOT, Dit has been found for the materials to be of the order of 1012 cm−2 eV−1 and it is originated to be in good agreement with published fabrication results at p-type doping level of 1×1017 cm−3. Numerical calculations and solutions are performed by MATLAB and device simulation is done by ATLAS.
Evolution of column density distributions within Orion A⋆
Stutz, A. M.; Kainulainen, J.
2015-05-01
We compare the structure of star-forming molecular clouds in different regions of Orion A to determine how the column density probability distribution function (N-PDF) varies with environmental conditions such as the fraction of young protostars. A correlation between the N-PDF slope and Class 0 protostar fraction has been previously observed in a low-mass star-formation region (Perseus); here we test whether a similar correlation is observed in a high-mass star-forming region. We used Herschel PACS and SPIRE cold dust emission observations to derive a column density map of Orion A. We used the Herschel Orion Protostar Survey catalog to accurately identify and classify the Orion A young stellar object content, including the cold and relatively short-lived Class 0 protostars (with a lifetime of ~0.14 Myr). We divided Orion A into eight independent regions of 0.25 square degrees (13.5 pc2); in each region we fit the N-PDF distribution with a power law, and we measured the fraction of Class 0 protostars. We used a maximum-likelihood method to measure the N-PDF power-law index without binning the column density data. We find that the Class 0 fraction is higher in regions with flatter column density distributions. We tested the effects of incompleteness, extinction-driven misclassification of Class 0 sources, resolution, and adopted pixel-scales. We show that these effects cannot account for the observed trend. Our observations demonstrate an association between the slope of the power-law N-PDF and the Class 0 fractions within Orion A. Various interpretations are discussed, including timescales based on the Class 0 protostar fraction assuming a constant star-formation rate. The observed relation suggests that the N-PDF can be related to an evolutionary state of the gas. If universal, such a relation permits evaluating the evolutionary state from the N-PDF power-law index at much greater distances than those accessible with protostar counts. Appendices are available in
Differential Density Statistics of Galaxy Distribution and the Luminosity Function
Albani, V V L; Ribeiro, M B; Stöger, W R; Albani, Vinicius V. L.; Iribarrem, Alvaro S.; Ribeiro, Marcelo B.; Stoeger, William R.
2006-01-01
This paper uses data obtained from the galaxy luminosity function (LF) to calculate two types of radial number densities statistics of the galaxy distribution as discussed in Ribeiro (2005), namely the differential density $\\gamma$ and the integral differential density $\\gamma^\\ast$. By applying the theory advanced by Ribeiro and Stoeger (2003), which connects the relativistic cosmology number counts with the astronomically derived LF, the differential number counts $dN/dz$ are extracted from the LF and used to calculate both $\\gamma$ and $\\gamma^\\ast$ with various cosmological distance definitions, namely the area distance, luminosity distance, galaxy area distance and redshift distance. LF data are taken from the CNOC2 galaxy redshift survey and $\\gamma$ and $\\gamma^\\ast$ are calculated for two cosmological models: Einstein-de Sitter and an $\\Omega_{m_0}=0.3$, $\\Omega_{\\Lambda_0}=0.7$ standard cosmology. The results confirm the strong dependency of both statistics on the distance definition, as predicted in...
Equilibrium charge-state distributions of highly stripped ions in carbon foils
International Nuclear Information System (INIS)
Asymmetric equilibrium charge-state distributions observed for heavy ions (Z approx. >= 7) in carbon foils at high velocities (v > 3.6 x 108 Z0sup(.)45 cm s-1) are closely approximated by a simple statistical distribution: the reduced chi-squared model. The dependences of the mean charge and of the standard deviation of the charge on the projectile velocity are obtained by a previously-known and a newly-proposed relation, respectively. Finally charge-state fractions may be easily predicted using a simple formula depending only on the atomic number and on the velocity of the projectile. (orig.)
Energy Technology Data Exchange (ETDEWEB)
2014-09-01
Increasing demand for electric vehicle (EV) charging provides an opportunity for market expansion of distributed solar technology. A major barrier to the current deployment of solar technology for EV charging is a lack of clear information for policy makers, utilities and potential adopters. This paper introduces the pros and cons of EV charging during the day versus at night, summarizes the benefits and grid implications of combining solar and EV charging technologies, and offers some regulatory and policy options available to policy makers and regulators wanting to incentivize solar EV charging.
Space Charge Neutralization of DEMO Relevant Negative Ion Beams at Low Gas Density
International Nuclear Information System (INIS)
The application of neutral beams to future power plant devices (DEMO) is dependent on achieving significantly improved electrical efficiency and the most promising route to achieving this is by implementing a photoneutralizer in place of the traditional gas neutralizer. A corollary of this innovation would be a significant reduction in the background gas density through which the beam is transported between the accelerator and the neutralizer. This background gas is responsible for the space charge neutralization of the beam, enabling distances of several metres to be traversed without significant beam expansion. This work investigates the sensitivity of a D- beam to reduced levels of space charge compensation for energies from 100 keV to 1.5 MeV, representative of a scaled prototype experiment, commissioning and full energy operation. A beam transport code, following the evolution of the phase space ellipse, is employed to investigate the effect of space charge on the beam optics. This shows that the higher energy beams are insensitive to large degrees of under compensation, unlike the lower energies. The probable degree of compensation at low gas density is then investigated through a simple, two component beam-plasma model that allows the potential to be negative. The degree of under-compensation is dependent on the positive plasma ion energy, one source of which is dissociation of the gas by the beam. The subsequent space charge state of the beam is shown to depend upon the relative times for equilibration of the dissociation energy and ionization by the beam ions.
Calculation of the Nuclear Transition Charge Density in a Microscopic sdgIBM-1
Institute of Scientific and Technical Information of China (English)
ZHANG Zhan-Jun; SANG Jian-ping; LIU Yong
2000-01-01
Formulae of proton and neutron boson structure functions (BSF's) are deduced in terms of a microscopic approach of sdgIBM (namely, microscopic sdgIBM). For the nucleus 190Os, the value of BSF's is worked out. Due to the high similarity, the maximum F-spin truncation is made under the full-symmetry approximation. Thereafter, calculations of E2 and E4 transition charge densities (TCD's) are performed in the sdgIBM-1. It is found that the E2 and E4 TCD's can be reproduced quite satisfactorily in the uniform frame of microscopic sdgIBM-1.
Origin of the charge density wave in 1T-TiSe2
Zhu, Zhiyong
2012-06-27
All-electron ab initio calculations are used to study the microscopic origin of the charge density wave (CDW) in 1T-TiSe2. A purely electronic picture is ruled out as a possible scenario, indicating that the CDW transition in the present system is merely a structural phase transition. The CDW instability is the result of a symmetry lowering by electron correlations occurring with electron localization. Suppression of the CDW in pressurized and in Cu-intercalated 1T-TiSe2 is explained by a delocalization of the electrons, which weakens the correlations and counteracts the symmetry lowering.
Metal-charge density wave coexistence in TTF[Ni(dmit){sub 2}]{sub 2}
Energy Technology Data Exchange (ETDEWEB)
Kaddour, W. [Laboratoire de Physique des Solides, UMR 8502-CNRS, Univ. Paris-Sud, Orsay F-91405 (France); Laboratoire de Physique de la Matière Condensée, Campus Universitaire, Université de Tunis El-Manar, Tunis 2092 (Tunisia); Auban-Senzier, P.; Raffy, H.; Monteverde, M.; Pouget, J.-P. [Laboratoire de Physique des Solides, UMR 8502-CNRS, Univ. Paris-Sud, Orsay F-91405 (France); Pasquier, C.R., E-mail: pasquier@lps.u-psud.fr [Laboratoire de Physique des Solides, UMR 8502-CNRS, Univ. Paris-Sud, Orsay F-91405 (France); Alemany, P. [Departament de Química Física and Institut de Química Teòrica i Computacional (IQTCUB), Universitat de Barcelona, Martí i Franquès 1, 08028 Barcelona (Spain); Canadell, E. [Institut de Ciència de Materials de Barcelona (CSIC), Campus UAB, 08193 Bellaterra (Spain); Valade, L. [Laboratoire de Chimie de Coordination, Route de Narbonne F-31077 Toulouse (France)
2015-03-01
We have established a new pressure–temperature phase diagram of TTF[Ni(dmit){sub 2}]{sub 2} based on longitudinal and transverse resistivity measurements under pressure up to 30 kbar. We were able to identify three different charge density wave (CDW) states which all coexist with a metallic state in a wide temperature range and superconductivity at the lowest temperatures. At low pressure, two successive CDW transitions have been clearly identified. These two transitions merge into a single one at 12 kbar. A maximum of this unique CDW transition temperature is observed at 19 kbar.
Scanning tunneling microscopy of charge-density waves in NbSe3
International Nuclear Information System (INIS)
The charge-density wave (CDW) structure in NbSe3 due to the two independent CDW's has been imaged by scanning microscopy. As predicted by band-structure considerations, the CDW modulation is observed to be substantially localized on different chains for the separate CDW's. AT 77 K where only the high-temperature CDW exists, a relatively weak modulation with a single component along the b axis is observed. At 4.2 K the low-temperature CDW contributes a much stronger ∼4b0 x 2c0 superlattice modulation
Nucleon to $\\Delta$ transition form factors and empirical transverse charge densities
Chakrabarti, Dipankar
2016-01-01
We investigate the nucleon to $\\Delta$ transition form factors in a soft-wall AdS/QCD model and a light-front quark-diquark model inspired by AdS/QCD. From the transition form factors we evaluate the transition charge densities which influences the nucleon to $\\Delta$ excitation. Here we consider both the unpolarized and the transversely polarized cases. The AdS/QCD predictions are compared with available experimental data and with the results of the global parameterization, MAID2007.
Measurements of charged-particle distributions with the ATLAS detector
Cairo, Valentina Maria Martina
2016-01-01
Inclusive charged-particle measurements probe the low-energy region of the non-perturbative quantum chromodynamics. The ATLAS collaboration has recently measured the charged-particle multiplicity and its dependence on transverse momentum and pseudorapidity in special data sets with low LHC beam currents, recorded at centre-of-mass energies of 8 TeV and 13 TeV. The measurements at 8 TeV cover a wide spectrum using charged-particle selections with minimum transverse momentum of both 100 MeV and 500 MeV and in various phase space regions of low and high charged-particle multiplicities, some of which are studied for the first time by ATLAS. The measurements at 13 TeV also present detailed studies with a minimum transverse momentum of both 100 MeV and 500 MeV. The measurements are compared with predictions of various tuned Monte Carlo generators and are found to provide strong constraints on these. None of the Monte Carlo generators with their respective tunes are able to reproduce all the features of the data.
Carbon density and distribution of six Chinese temperate forests
Institute of Scientific and Technical Information of China (English)
无
2010-01-01
Quantifying forest carbon(C) storage and distribution is important for forest C cycling studies and terrestrial ecosystem modeling.Forest inventory and allometric approaches were used to measure C density and allocation in six representative temperate forests of similar stand age(42-59 years old) and growing under the same climate in northeastern China.The forests were an aspen-birch forest,a hardwood forest,a Korean pine plantation,a Dahurian larch plantation,a mixed deciduous forest,and a Mongolian oak forest.There were no significant differences in the C densities of ecosystem components(except for detritus) although the six forests had varying vegetation compositions and site conditions.However,the differences were significant when the C pools were normalized against stand basal area.The total ecosystem C density varied from 186.9 tC hm-2 to 349.2 tC hm-2 across the forests.The C densities of vegetation,detritus,and soil ranged from 86.3-122.7 tC hm-2,6.5-10.5 tC hm-2,and 93.7-220.1 tC hm-2,respectively,which accounted for 39.7% ± 7.1%(mean ± SD),3.3% ± 1.1%,and 57.0% ± 7.9% of the total C densities,respectively.The overstory C pool accounted for > 99% of the total vegetation C pool.The foliage biomass,small root(diameter < 5mm) biomass,root-shoot ratio,and small root to foliage biomass ratio varied from 2.08-4.72 tC hm-2,0.95-3.24 tC hm-2,22.0%-28.3%,and 34.5%-122.2%,respectively.The Korean pine plantation had the lowest foliage production efficiency(total biomass/foliage biomass:22.6 g g-1) among the six forests,while the Dahurian larch plantation had the highest small root production efficiency(total biomass/small root biomass:124.7 g g-1).The small root C density decreased with soil depth for all forests except for the Mongolian oak forest,in which the small roots tended to be vertically distributed downwards.The C density of coarse woody debris was significantly less in the two plantations than in the four naturally regenerated forests.The variability
Effects of Horizontal Density Distribution on Internal Bond Strength of Flakeboard
Institute of Scientific and Technical Information of China (English)
MEIChangtong; DAIChunping; ZHOUDingguo
2005-01-01
Horizontal density variation is a structural phenomenon of non-veneer wood composites. The variation and distribution characteristics of horizontal density have impacts on the products properties. In this study, veneer strip simulated flake boards with 4 kinds of density distribution were made using a mat model. The density variation of the modeled mats was discussed, as well as the relationship between sample size and density variation. The effects of density and density distribution of non-veneer composites on the internal bond strength were analyzed. Result shows that the horizontal density of random formed particleboard follows normal distribution. Density has remarkable influence on internal bond strength (IB). Increasing density helps to improve IB at lower density stage, but has negative impacts on IB at higher density stage.Density variation between testing specimens depends on their sizes. Properly increasing specimen size can decrease the variation of the IBs.
Ke, Weiyao; Bernhard, Jonah E; Bass, Steffen A
2016-01-01
We study the initial three-dimensional spatial configuration of the quark-gluon plasma produced in relativistic heavy-ion collisions using centrality and rapidity-dependent measurements of charged particle pseudorapidity densities and two-particle correlations. A cumulant-generating function is used to parametrize the rapidity dependence of local entropy deposition and extend arbitrary boost-invariant initial conditions to nonzero beam rapidities. The model is compared to p+Pb and Pb+Pb single-particle distributions and systematically optimized using Bayesian parameter estimation to extract high-probability initial condition parameters. The optimized initial conditions are then compared to a number of experimental observables including two-particle rapidity correlations, the rapidity dependence of anisotropic flow, and event-plane decorrelations.
International Nuclear Information System (INIS)
The influence of the intermolecular interactions on the vibrational dynamics of 1-indanone has been checked by simulating the INS spectrum from molecular and DFT periodic calculations, showing that, even in the case of weak hydrogen bonds, those modes associated with lower energy transfer are affected in the solid state. The electron charge distribution of solid 1-indanone has also been studied from a DFT periodic calculation. In order to obtain some insight into the intermolecular interactions Bader's atoms in molecules theory has been used. After a careful analysis of the topological properties of the calculated electron density, bond paths, critical points and other related properties, most of the C-H...π and C-H...O weak hydrogen bonds predicted in the experimental X-ray structure are confirmed. In addition some new H?H interactions were found. Furthermore, a natural bond orbital analysis was performed describing each hydrogen bond as donor-acceptor interactions
Pseudorapidity distribution of charged hadrons in proton-proton collisions at $\\sqrt{s} =$ 13 TeV
Khachatryan, Vardan; Tumasyan, Armen; Adam, Wolfgang; Aşılar, Ece; Bergauer, Thomas; Brandstetter, Johannes; Brondolin, Erica; Dragicevic, Marko; Erö, Janos; Flechl, Martin; Friedl, Markus; Fruehwirth, Rudolf; Ghete, Vasile Mihai; Hartl, Christian; Hörmann, Natascha; Hrubec, Josef; Jeitler, Manfred; Knünz, Valentin; König, Axel; Krammer, Manfred; Krätschmer, Ilse; Liko, Dietrich; Matsushita, Takashi; Mikulec, Ivan; Rabady, Dinyar; Rahbaran, Babak; Rohringer, Herbert; Schieck, Jochen; Schöfbeck, Robert; Strauss, Josef; Treberer-Treberspurg, Wolfgang; Waltenberger, Wolfgang; Wulz, Claudia-Elisabeth; Mossolov, Vladimir; Shumeiko, Nikolai; Suarez Gonzalez, Juan; Alderweireldt, Sara; Cornelis, Tom; De Wolf, Eddi A; Janssen, Xavier; Knutsson, Albert; Lauwers, Jasper; Luyckx, Sten; Van De Klundert, Merijn; Van Haevermaet, Hans; Van Mechelen, Pierre; Van Remortel, Nick; Van Spilbeeck, Alex; Abu Zeid, Shimaa; Blekman, Freya; D'Hondt, Jorgen; Daci, Nadir; De Bruyn, Isabelle; Deroover, Kevin; Heracleous, Natalie; Keaveney, James; Lowette, Steven; Moreels, Lieselotte; Olbrechts, Annik; Python, Quentin; Strom, Derek; Tavernier, Stefaan; Van Doninck, Walter; Van Mulders, Petra; Van Onsem, Gerrit Patrick; Van Parijs, Isis; Barria, Patrizia; Brun, Hugues; Caillol, Cécile; Clerbaux, Barbara; De Lentdecker, Gilles; Fasanella, Giuseppe; Favart, Laurent; Grebenyuk, Anastasia; Karapostoli, Georgia; Lenzi, Thomas; Léonard, Alexandre; Maerschalk, Thierry; Marinov, Andrey; Perniè, Luca; Randle-conde, Aidan; Reis, Thomas; Seva, Tomislav; Vander Velde, Catherine; Vanlaer, Pascal; Yonamine, Ryo; Zenoni, Florian; Zhang, Fengwangdong; Beernaert, Kelly; Benucci, Leonardo; Cimmino, Anna; Crucy, Shannon; Dobur, Didar; Fagot, Alexis; Garcia, Guillaume; Gul, Muhammad; Mccartin, Joseph; Ocampo Rios, Alberto Andres; Poyraz, Deniz; Ryckbosch, Dirk; Salva Diblen, Sinem; Sigamani, Michael; Strobbe, Nadja; Tytgat, Michael; Van Driessche, Ward; Yazgan, Efe; Zaganidis, Nicolas; Basegmez, Suzan; Beluffi, Camille; Bondu, Olivier; Brochet, Sébastien; Bruno, Giacomo; Caudron, Adrien; Ceard, Ludivine; Da Silveira, Gustavo Gil; Delaere, Christophe; Favart, Denis; Forthomme, Laurent; Giammanco, Andrea; Hollar, Jonathan; Jafari, Abideh; Jez, Pavel; Komm, Matthias; Lemaitre, Vincent; Mertens, Alexandre; Nuttens, Claude; Perrini, Lucia; Pin, Arnaud; Piotrzkowski, Krzysztof; Popov, Andrey; Quertenmont, Loic; Selvaggi, Michele; Vidal Marono, Miguel; Beliy, Nikita; Hammad, Gregory Habib; Aldá Júnior, Walter Luiz; Alves, Gilvan; Brito, Lucas; Correa Martins Junior, Marcos; Hamer, Matthias; Hensel, Carsten; Mora Herrera, Clemencia; Moraes, Arthur; Pol, Maria Elena; Rebello Teles, Patricia; Belchior Batista Das Chagas, Ewerton; Carvalho, Wagner; Chinellato, Jose; Custódio, Analu; Da Costa, Eliza Melo; De Jesus Damiao, Dilson; De Oliveira Martins, Carley; Fonseca De Souza, Sandro; Huertas Guativa, Lina Milena; Malbouisson, Helena; Matos Figueiredo, Diego; Mundim, Luiz; Nogima, Helio; Prado Da Silva, Wanda Lucia; Santoro, Alberto; Sznajder, Andre; Tonelli Manganote, Edmilson José; Vilela Pereira, Antonio; Ahuja, Sudha; Bernardes, Cesar Augusto; De Souza Santos, Angelo; Dogra, Sunil; Tomei, Thiago; De Moraes Gregores, Eduardo; Mercadante, Pedro G; Moon, Chang-Seong; Novaes, Sergio F; Padula, Sandra; Romero Abad, David; Ruiz Vargas, José Cupertino; Aleksandrov, Aleksandar; Hadjiiska, Roumyana; Iaydjiev, Plamen; Rodozov, Mircho; Stoykova, Stefka; Sultanov, Georgi; Vutova, Mariana; Dimitrov, Anton; Glushkov, Ivan; Litov, Leander; Pavlov, Borislav; Petkov, Peicho; Ahmad, Muhammad; Bian, Jian-Guo; Chen, Guo-Ming; Chen, He-Sheng; Chen, Mingshui; Cheng, Tongguang; Du, Ran; Jiang, Chun-Hua; Plestina, Roko; Romeo, Francesco; Shaheen, Sarmad Masood; Tao, Junquan; Wang, Chunjie; Wang, Zheng; Zhang, Huaqiao; Asawatangtrakuldee, Chayanit; Ban, Yong; Li, Qiang; Liu, Shuai; Mao, Yajun; Qian, Si-Jin; Wang, Dayong; Xu, Zijun; Avila, Carlos; Cabrera, Andrés; Chaparro Sierra, Luisa Fernanda; Florez, Carlos; Gomez, Juan Pablo; Gomez Moreno, Bernardo; Sanabria, Juan Carlos; Godinovic, Nikola; Lelas, Damir; Puljak, Ivica; Ribeiro Cipriano, Pedro M; Antunovic, Zeljko; Kovac, Marko; Brigljevic, Vuko; Kadija, Kreso; Luetic, Jelena; Micanovic, Sasa; Sudic, Lucija; Attikis, Alexandros; Mavromanolakis, Georgios; Mousa, Jehad; Nicolaou, Charalambos; Ptochos, Fotios; Razis, Panos A; Rykaczewski, Hans; Bodlak, Martin; Finger, Miroslav; Finger Jr, Michael; Assran, Yasser; El Sawy, Mai; Elgammal, Sherif; Ellithi Kamel, Ali; Kamel, Mohamed; Mahmoud, Mohammed
2015-01-01
The pseudorapidity distribution of charged hadrons in pp collisions at $\\sqrt{s} =$ 13 TeV is measured using a data sample obtained with the CMS detector, operated at zero magnetic field, at the CERN LHC. The yield of primary charged long-lived hadrons produced in inelastic pp collisions is determined in the central region of the CMS pixel detector ($|\\eta|$ < 2) using both hit pairs and reconstructed tracks. For central pseudo-rapidities ($|\\eta|$ < 0.5), the charged-hadron multiplicity density ${\\rm d}N_{\\rm ch}/{\\rm d}\\eta | _{|\\eta| {\\rm\\ < 0.5}}$ = $5.49 \\pm 0.01 {\\rm\\ (stat)} \\pm 0.17 {\\rm\\ (syst)}$ , a value obtained by combining the two methods. The result is compared to predictions from Monte Carlo event generators and to similar measurements made at lower collision energie.
Darancet, Pierre; Millis, Andrew J.; Marianetti, Chris A.
2013-03-01
Transition metal dichalcogenides (TMDC) are layered materials displaying a variety of charge-density wave (CDW) instabilities and complex phase diagrams for group IV & V transition metals. Recent progress in mechanical exfoliation and device fabrication now allow for electrical characterization and gating of individual, 3-atom thick layers of TMDCs, providing new probes of the complex many-body interactions arising in these compounds. In this talk, I will present our investigations using density functional and dynamical mean-field theory regarding the electronic structure and electronic correlations arising in distorted monolayers, bilayers, and trilayers of octahedral group V TMDCs. We will examine the importance of doping, crystal fields, and many-body interactions, and their influence on the transport and optical properties of these materials upon distortion. Computational resources provided by New York Center for Computational Sciences at SBU/BNL supported by the U.S. DOE under Contract No. DE-AC02-98CH10886
Institute of Scientific and Technical Information of China (English)
Zhang Li-Ping; Xue Ju-Kui; Li Yan-Long
2011-01-01
Both linear and nonlinear excitation in dusty plasmas have been investigated including the nonadiabatic dust charge fluctuation and Gaussian size distribution dust particles.A linear dispersion relation and a Korteweg-de VriesBurgers equation governing the dust acoustic shock waves are obtained.The relevance of the instability of wave and the wave evolution to the dust size distribution and nonadiabatic dust charge fluctuation is illustrated both analytically and numerically.The numerical results show that the Gaussian size distribution of dust particles and the nonadiabatic dust charge fluctuation have strong common influence on the propagation of both linear and nonlinear excitations.
Klink, Stefan; Schuhmann, Wolfgang; La Mantia, Fabio
2014-08-01
Porous lithium ion battery electrodes are characterized using a vertical distribution of cross-currents. In an appropriate simplification, this distribution can be described by a transmission line model (TLM) consisting of infinitely thin electrode layers. To investigate the vertical distribution of currents, overpotentials, and irreversible charge losses in a porous graphite electrode in situ, a multi-layered working electrode (MWE) was developed as the experimental analogue of a TLM. In this MWE, each layer is in ionic contact but electrically insulated from the other layers by a porous separator. It was found that the negative graphite electrodes get lithiated and delithiated stage-by-stage and layer-by-layer. Several mass-transport- as well as non-mass-transport-limited processes could be identified. Local current densities can reach double the average, especially on the outermost layer at the beginning of each intercalation stage. Furthermore, graphite particles close to the counter electrode act as "electrochemical sieve" reducing the impurities present in the electrolyte such as water.
Fahr, H. J.; Fichtner, H.; Scherer, K.
2015-12-01
We consider the evolution of the solar wind ion distribution function alongthe plasma flow downstream from the termination shock induced by chargeexchange processes with cold interstellar H-atoms. We start from a kineticphase space transport equation valid in the bulk frame of the plasma flowthat takes into account convective changes, cooling processes, energydiffusion and ion injection, and describes solar wind and pick-up ionsas a co-moving, isotropic, joint ion population. From this kinetic transportequation one can ascend to an equation for the pressure moment of the iondistribution function, a so-called pressure transport equation, describingthe evolution of the ion pressure in the comoving rest frame. Assuming thatthe local ion distribution can be represented by an adequate kappa functionwith a kappa parameter that varies with the streamline coordinate, weobtain an ordinary differential equation for kappa as function of thestreamline coordinate s. With this result then we gain the heliosheath iondistribution function downstream of the termination shock. The latter thencan be used to predict the Voyager-2 measured moments of the distributionfunction like ion density and ion temperature, and it can also be used topredict spectral fluxes of ENA`s originating from these ions and registeredby IBEX-Hi and IBEX-Lo.We especially analyse the solar wind ion temperature decreasemeasured by Voyager-2 between the years 2008 to 2011 and try to explain itas a charge-exchange induced cooling of the ion distribution function duringthe associated ion convection period.
Naima, Boubegra; Abdelkader, Chouaih; Mokhtaria, Drissi; Fodil, Hamzaoui
2014-01-01
The 4,4 dimethyl amino cyano biphenyl crystal (DMACB) is characterized by its nonlinear activity. The intra molecular charge transfer of this molecule results mainly from the electronic transmission of the electro-acceptor (cyano) and electro-donor (di-methyl-amino) groups. An accurate electron density distribution around the molecule has been calculated based on a high-resolution X-ray diffraction study. The data were collected at 123 K using graphite-monochromated Mo K α radiation to sin(β)/λ = 1.24 Å-1. The integrated intensities of 13796 reflections were measured and reduced to 6501 independent reflections with I >= 3σ(I). The crystal structure was refined using the experimental model of Hansen and Coppens (1978). The crystal structure has been validated and deposited at the Cambridge Crystallographic Data Centre with the deposition number CCDC 876507. In this article, we present the thermal motion and the structural analysis obtained from the least-square refinement based on F2 and the electron density distribution obtained from the multipolar model.
International Nuclear Information System (INIS)
The 4,4 dimethyl amino cyano biphenyl crystal (DMACB) is characterized by its nonlinear activity. The intra molecular charge transfer of this molecule results mainly from the electronic transmission of the electro-acceptor (cyano) and electro-donor (di-methyl-amino) groups. An accurate electron density distribution around the molecule has been calculated based on a high-resolution X-ray diffraction study. The data were collected at 123 K using graphite-monochromated Mo K α radiation to sin(β)/λ = 1.24 Å−1. The integrated intensities of 13796 reflections were measured and reduced to 6501 independent reflections with I ≥ 3σ(I). The crystal structure was refined using the experimental model of Hansen and Coppens (1978). The crystal structure has been validated and deposited at the Cambridge Crystallographic Data Centre with the deposition number CCDC 876507. In this article, we present the thermal motion and the structural analysis obtained from the least-square refinement based on F2 and the electron density distribution obtained from the multipolar model. (condensed matter: structural, mechanical, and thermal properties)
DEFF Research Database (Denmark)
Kordheili, Reza Ahmadi; Bak-Jensen, Birgitte; Pillai, Jayakrishnan Radhakrishna;
2015-01-01
This paper proposes different smart charging algorithms for electric vehicles (EVs) to find out the maximum grid capability in dealing with these new devices. The main objective is to obtain maximum EV penetration in the distribution grid without reinforcing the grid in order to avoid any cost...... for distribution system operators (DSOs). Two smart charging algorithms are proposed in this study. The proposed algorithms are applied to a part of the Danish distribution grid as a case study. As a comparison, a dumb charging scenario, i.e. charging EVs without any specific order or algorithm, is also simulated....... Simulation results demonstrate the capability of the smart charging methods to increase the penetration of EVs up to three times, compared to the base case....
Angular momentum of disc galaxies with a lognormal density distribution
Marr, John Herbert
2015-01-01
Whilst most galaxy properties scale with galaxy mass, similar scaling relations for angular momentum are harder to demonstrate. A lognormal (LN) density distribution for disc mass provides a good overall fit to the observational data for disc rotation curves for a wide variety of galaxy types and luminosities. In this paper, the total angular momentum J and energy $\\vert{}$E$\\vert{}$ were computed for 38 disc galaxies from the published rotation curves and plotted against the derived disc masses, with best fit slopes of 1.683$\\pm{}$0.018 and 1.643$\\pm{}$0.038 respectively, using a theoretical model with a LN density profile. The derived mean disc spin parameter was $\\lambda{}$=0.423$\\pm{}$0.014. Using the rotation curve parameters V$_{max}$ and R$_{max}$ as surrogates for the virial velocity and radius, the virial mass estimator $M_{disc}\\propto{}R_{max}V_{max}^2$ was also generated, with a log-log slope of 1.024$\\pm{}$0.014 for the 38 galaxies, and a proportionality constant ${\\lambda{}}^*=1.47\\pm{}0.20\\time...
Topology density correlator on dynamical domain-wall ensembles with nearly frozen topological charge
Fukaya, H; Cossu, G; Hashimoto, S; Kaneko, T; Noaki, J
2014-01-01
Global topological charge decorrelates very slowly or even freezes in fine lattice simulations. On the other hand, its local fluctuations are expected to survive and lead to the correct physical results as long as the volume is large enough. We investigate this issue on recently generated configurations including dynamical domain-wall fermions at lattice spacings a = 0.08 fm and finer. We utilize the Yang-Mills gradient flow to define the topological charge density operator and calculate its long-distance correlation, through which we propose a new method for extracting the topological susceptibility in a sub-volume. This method takes care of the finite volume correction, which reduces the bias caused by the global topological charge. Our lattice data clearly show a shorter auto-correlation time than that of the naive definition using the whole lattice, and are less sensitive to the global topological history. Numerical results show a clear sea-quark mass dependence, which agrees well with the prediction of c...
Density functional theory for the description of charge-transfer processes at TTF/TCNQ interfaces
Van Regemorter, Tanguy
2012-09-15
In the field of organic electronics, a central issue is to assess how the frontier electronic levels of two adjacent organic layers align with respect to one another at the interface. This alignment can be driven by the presence of a partial charge transfer and the formation of an interface dipole; it plays a key role for instance in determining the rates of exciton dissociation or exciton formation in organic solar cells or light-emitting diodes, respectively. Reliably modeling the processes taking place at these interfaces remains a challenge for the computational chemistry community. Here, we review our recent theoretical work on the influence of the choice of density functional theory (DFT) methodology on the description of the charge-transfer character in the ground state of TTF/ TCNQ model complexes and interfaces. Starting with the electronic properties of the isolated TTF and TCNQ molecules and then considering the charge transfer and resulting interface dipole in TTF/TCNQ donor-acceptor stacks and bilayers, we examine the impact of the choice of DFT functional in describing the interfacial electronic structure. Finally, we employ computations based on periodic boundary conditions to highlight the impact of depolarization effects on the interfacial dipole moment. © Springer-Verlag 2012.
Directory of Open Access Journals (Sweden)
Du Chongyang
2015-01-01
Full Text Available Electric vehicles are the most potential transports in the future. However, the large scale of charging facilities will make a great influence on gird. There is a need to make a research on the construction of charging facilities. Based on the power demand characteristics of electric vehicle charging, distribution network capacity, charging system performance and other aspects, this paper mainly researched the deployment strategy of charging piles. First, the authors built up a model with characteristics of charging power demand of electric vehicle and a model of charging service system. The characteristic of daily load curve is analyzed. Second, based on these works, the authors designed the progress of strategy making. At last, the progress was verified by the actual use case.
Gandiwa, E.
2014-01-01
Understanding factors influencing large herbivore densities and distribution in terrestrial ecosystems is a fundamental goal of ecology. This study examined environmental factors influencing the density and distribution of wild large herbivores in Gonarezhou National Park, Zimbabwe. Vegetation and s
Institute of Scientific and Technical Information of China (English)
Yu-ling Chu; Zhong Yang; Zhe-feng Pan; Jing Liu; Yue-yi Han; Yong Ding; Peng Song
2012-01-01
Density functional theory and time-dependent density-functional theory have been used to investigate the photophysical properties and relaxation dynamics of dimethylaminobenzophenone (DMABP) and its hydrogen-bonded DMABP-MeOH dimer.It is found that,in nonpolar aprotic solvent,the transitions from S0 to S1 and S2 states of DMABP have both n→π* and π→π* characters,with the locally excited feature mainly located on the C=O group and the partial CT one characterized by electron transfer mainly from the dimethylaminophenyl group to the C=O group.But when the intermolecular hydrogen bond C=O…H-O is formed,the highly polar intramolecular charge transfer character switches over to the first excited state of DMABP-MeOH dimer and the energy difference between the two lowlying electronically excited states increases.To gain insight into the relaxation dynamics of DMABP and DMABP-MeOH dimer in the excited state,the potential energy curves for conformational relaxation are calculated.The formation of twisted intramolecular charge transfer state via diffusive twisting motion of the dimethylamino/dimethylaminophenyl groups is found to be the major relaxation process.In addition,the decay of the S1 state of DMABP-MeOH dimer to the ground state,through nonradiative intermolecular hydrogen bond stretching vibrations,is facilitated by the formation of the hydrogen bond between DMABP and alcohols.
Low temperature thermoelectric properties of Cu intercalated TiSe2: a charge density wave material
Bhatt, Ranu; Basu, Ranita; Bhattacharya, S.; Singh, A.; Aswal, D. K.; Gupta, S. K.; Okram, G. S.; Ganesan, V.; Venkateshwarlu, D.; Surgers, C.; Navaneethan, M.; Hayakawa, Y.
2013-05-01
In this communication, we investigate the thermoelectric properties of a charge density wave material TiSe2 upon Cu intercalation. Polycrystalline Cu x TiSe2 ( x=0-0.11) alloys were synthesized using solid state sintering process and their morphological and structural properties were investigated. The material grows in layered morphology and the c-lattice parameter increases linearly with x. The temperature dependent resistivity measured in the 300-5 K range, shows that increasing x leads to a systematic transition from charge density wave state to the metallic state. For x=0.11, the room temperature thermoelectric figure-of-merit is found to be 0.104, which is higher by seven orders in magnitude (i.e. 1.93×10-8) measured for pristine TiSe2 and comparable to the other reported thermoelectric materials. These results show that Cu x TiSe2 are a potential material for the low temperature thermoelectric applications.
Superconductivity and Charge Density Wave in ZrTe3-xSex.
Zhu, Xiangde; Ning, Wei; Li, Lijun; Ling, Langsheng; Zhang, Ranran; Zhang, Jinglei; Wang, Kefeng; Liu, Yu; Pi, Li; Ma, Yongchang; Du, Haifeng; Tian, Minglian; Sun, Yuping; Petrovic, Cedomir; Zhang, Yuheng
2016-01-01
Charge density wave (CDW), the periodic modulation of the electronic charge density, will open a gap on the Fermi surface that commonly leads to decreased or vanishing conductivity. On the other hand superconductivity, a commonly believed competing order, features a Fermi surface gap that results in infinite conductivity. Here we report that superconductivity emerges upon Se doping in CDW conductor ZrTe3 when the long range CDW order is gradually suppressed. Superconducting critical temperature Tc(x) in ZrTe3-xSex (0 ≤ x ≤ 0.1) increases up to 4 K plateau for 0.04 ≤ x ≤ 0.07. Further increase in Se content results in diminishing Tc and filametary superconductivity. The CDW modes from Raman spectra are observed in x = 0.04 and 0.1 crystals, where signature of ZrTe3 CDW order in resistivity vanishes. The electronic-scattering for high Tc crystals is dominated by local CDW fluctuations at high temperatures, the resistivity is linear up to highest measured T = 300 K and contributes to substantial in-plane anisotropy. PMID:27253150
Charge density wave in layered La1 -xCexSb2
Luccas, R. F.; Fente, A.; Hanko, J.; Correa-Orellana, A.; Herrera, E.; Climent-Pascual, E.; Azpeitia, J.; Pérez-Castañeda, T.; Osorio, M. R.; Salas-Colera, E.; Nemes, N. M.; Mompean, F. J.; García-Hernández, M.; Rodrigo, J. G.; Ramos, M. A.; Guillamón, I.; Vieira, S.; Suderow, H.
2015-12-01
The layered rare-earth diantimonides R Sb2 are anisotropic metals with generally low electronic densities whose properties can be modified by substituting the rare earth. LaSb2 is a nonmagnetic metal with a low residual resistivity presenting a low-temperature magnetoresistance that does not saturate with the magnetic field. It has been proposed that the latter can be associated to a charge density wave (CDW), but no CDW has yet been found. Here we find a kink in the resistivity above room temperature in LaSb2 (at 355 K) and show that the kink becomes much more pronounced with substitution of La by Ce along the La1 -xCexSb2 series. We find signatures of a CDW in x-ray scattering, specific heat, and scanning tunneling microscopy (STM) experiments in particular for x ≈0.5 . We observe a distortion of rare-earth-Sb bonds lying in-plane of the tetragonal crystal using x-ray scattering, an anomaly in the specific heat at the same temperature as the kink in resistivity and charge modulations in STM. We conclude that LaSb2 has a CDW which is stabilized in the La1 -xCexSb2 series due to substitutional disorder.
Probabilistic Harmonic Calculation in Distribution Networks with Electric Vehicle Charging Stations
Directory of Open Access Journals (Sweden)
Jianxue Wang
2014-01-01
Full Text Available Integrating EV charging station into power grid will bring impacts on power system, among which the most significant one is the harmonic pollution on distribution networks. Due to the uncertainty of the EV charging process, the harmonic currents brought by EV charging stations have a random nature. This paper proposed a mathematical simulation method for studying the working status of charging stations, which considers influencing factors including random leaving factor, electricity price, and waiting time. Based on the proposed simulation method, the probability distribution of the harmonic currents of EV charging stations is obtained and used in the calculation of the probability harmonic power flow. Then the impacts of EVs and EV charging stations on distribution networks can be analyzed. In the case study, the proposed simulation and analysis method is implemented on the IEEE-34 distribution network. The influences of EV arrival rates, the penetration rate, and the accessing location of EV charging station are also investigated. Results show that this research has good potential in guiding the planning and construction of charging station.
Directory of Open Access Journals (Sweden)
Cristina Stancu
2009-10-01
Full Text Available A computation method of the electricfield and ionic space charge density in planeinsulations with water trees (using a ComsolMultiphysics software and the thermal step currents(Im(t measured with Thermal Step Method ispresented. A parabolic spatial variation of volumecharge density, an exponential spatial variation ofthe electric permittivity ε and a linear dependency ofε and the temperature coefficient of permittivity αεwith the average water concentration in trees, areconsidered. For a water tree with a known length,different values of charge density are consideredand the electric field and the thermal step currentsIc(t are calculated. The currents Ic(t and Im(t arecompared and the volume of charge density andelectric field for which Ic(t is identical with Im(t arekept.
Kurniawan, Andi; Tsuchiya, Yuki; Eda, Shima; Morisaki, Hisao
2015-12-01
Biofilm polymers contain both electrically positively and negatively charged sites. These charged sites enable the biofilm to trap and retain ions leading to an important role of biofilm such as nutrient recycling and pollutant purification. Much work has focused on the ion-exchange capacity of biofilms, and they are known to adsorb ions through an exchange mechanism between the ions in solution and the ions adsorbed to the charged sites on the biofilm polymer. However, recent studies suggest that the adsorption/desorption behavior of ions in a biofilm cannot be explained solely by this ion exchange mechanism. To examine the possibility that a substantial amount of ions are held in the interstitial region of the biofilm polymer by an electrostatic interaction, intact biofilms formed in a natural environment were immersed in distilled water and ion desorption was investigated. All of the detected ion species were released from the biofilms over a short period of time, and very few ions were subsequently released over more time, indicating that the interstitial region of biofilm polymers is another ion reserve. The extent of ion retention in the interstitial region of biofilms for each ion can be determined largely by charge density, |Z|/r, where |Z| is the ion valence as absolute value and r is the ion radius. The higher |Z|/r value an ion has, the stronger it is retained in the interstitial region of biofilms. Ion shape is also a key determinant of ion retention. Spherical and non-spherical ions have different correlations between the condensation ratio and |Z|/r. The generality of these findings were assured by various biofilm samples. Thus, the internal regions of biofilms exchange ions dynamically with the outside environment.
Distribution Locational Marginal Pricing for Optimal Electric Vehicle Charging Management
DEFF Research Database (Denmark)
Li, Ruoyang; Wu, Qiuwei; Oren, Shmuel S.
2013-01-01
This paper presents an integrated distribution locational marginal pricing (DLMP) method designed to alleviate congestion induced by electric vehicle (EV) loads in future power systems. In the proposed approach, the distribution system operator (DSO) determines distribution locational marginal...... prices (DLMPs) by solving the social welfare optimization of the Electric distribution system which considers EV aggregators as Price takers in the local DSO market and demand price elasticity. Nonlinear optimization has been used to solve the social welfare optimization problem in order to obtain...... the DLMPs. The efficacy of the proposed approach was demonstrated by using the bus 4 distribution system of the Roy Billinton Test System (RBTS) and Danish driving data. The case study results show that the integrated DLMP methodology can successfully alleviate the congestion caused by EV loads. It is also...
Goiffon, Vincent; Virmontois, Cédric; Magnan, Pierre; Girard, Sylvain; Paillet, Philippe
2010-01-01
The origin of total ionizing dose induced dark current in CMOS image sensors is investigated by comparing dark current measurements to interface state density and trapped charge density measurements. Two types of photodiode and several thick-oxide-FETs were manufactured using a 0,18 um CMOS image sensor process and exposed to 10 keV X-ray from 3 krad to 1 Mrad. It is shown that the radiation induced trapped charge extends the space charge region at the oxide interface, leading to an enhanceme...
Latychevskaia, Tatiana; Escher, Conrad; Fink, Hans-Werner
2016-01-01
While imaging individual atoms can routinely be achieved in high resolution transmission electron microscopy, visualizing the potential distribution of individually charged adsorbates leading to a phase shift of the probing electron wave is still a challenging task. Since low-energy electrons are sensitive to localized potential gradients, we employed this tool in the 30 eV kinetic energy range to visualize the potential distribution of localized charged adsorbates present on free-standing graphene.
Kluge, T.; Bussmann, M.; Chung, H.-K.; Gutt, C.; Huang, L. G.; Zacharias, M.; Schramm, U.; Cowan, T. E.
2016-03-01
Here, we propose to exploit the low energy bandwidth, small wavelength, and penetration power of ultrashort pulses from XFELs for resonant Small Angle Scattering (SAXS) on plasma structures in laser excited plasmas. Small angle scattering allows to detect nanoscale density fluctuations in forward scattering direction. Typically, the SAXS signal from laser excited plasmas is expected to be dominated by the free electron distribution. We propose that the ionic scattering signal becomes visible when the X-ray energy is in resonance with an electron transition between two bound states (resonant coherent X-ray diffraction). In this case, the scattering cross-section dramatically increases so that the signal of X-ray scattering from ions silhouettes against the free electron scattering background which allows to measure the opacity and derived quantities with high spatial and temporal resolution, being fundamentally limited only by the X-ray wavelength and timing. Deriving quantities such as ion spatial distribution, charge state distribution, and plasma temperature with such high spatial and temporal resolution will make a vast number of processes in shortpulse laser-solid interaction accessible for direct experimental observation, e.g., hole-boring and shock propagation, filamentation and instability dynamics, electron transport, heating, and ultrafast ionization dynamics.
Determination of the charge state distribution of a highly ionized coronal Au plasma
International Nuclear Information System (INIS)
We present the first definitive measurement of the charge state distribution of a highly ionized gold plasma in coronal equilibrium. The experiment utilized the Livermore electron beam ion trap EBIT-II in a novel configuration to create a plasma with a Maxwellian temperature of 2.5 keV. The charge balance in the plasma was inferred from spectral line emission measurements which accounted for charge exchange effects. The measured average ionization state was 46.8±0.75. This differs from the predictions of two modeling codes by up to four charge states
An axisymmetric charged dust distribution with NUT rotation in general relativity
Vargas-Rodriguez, H.; Gonzalez-Silva, R. A.; Lopez Benitez, L. I.
2010-07-01
An exact solution of the Einstein-Maxwell's field equations is presented. This solution describes an axisymmetric charged dust distribution, with NUT rotation, in the presence of an electromagnetic field of the pure magnetic type. In the comoving reference frame, there is magnetic field only, the dust's electric charges do not interact with themselves, this is due to the vanishing of the Lorentz force. A naked singularity with magnetic charge is present. The solution is of the Petrov type D and possesses four Killing vectors. This is a generalization of the Lukács solution to the case when dust is charged.
Energy Technology Data Exchange (ETDEWEB)
Dougar-Jabon, V.D. [Escuela de Fisica, Universidad Industrial de Santander, A.A. 678, Bucaramanga (Colombia); Umnov, A.M. [Russian Friendship University, 117198 Moscow (Russia); Kutner, V.B. [Joint Institute for Nuclear Research, Dubna (Russia)
1996-03-01
It is common knowledge that the electrostatic pit in a core plasma of electron cyclotron resonance sources exerts strict control over generation of ions in high charge states. This work is aimed at finding a dependence of the lifetime of ions on their charge states in the core region and to elaborate a numerical model of ion charge dispersion not only for the core plasmas but for extracted beams as well. The calculated data are in good agreement with the experimental results on charge distributions and magnitudes for currents of beams extracted from the 14 GHz DECRIS source. {copyright} {ital 1996 American Institute of Physics.}
Sun, Guangyu; Kurti, Jeno; Kertesz, Miklos; Baughman, Ray H.
2002-10-01
Charge-induced dimensional changes allow conducting polymers and single walled carbon nanotubes to function as electromechanical actuators. The unit cell of the prototypical conducting polymer, trans-polyacetylene, was calculated as a function of charge injection using density functional theory in combination with ultrasoft pseudopotentials using the solid-state Vienna ab initio simulation package. Test calculations on the charged pyridinium molecular ion give results in good agreement with the experimental geometry. Strain versus charge relationships are predicted from dimensional changes calculated using a uniform background charge ("jellium") for representing the counterions, which we show provides results consistent with experiment for doped polyacetylenes. These jellium calculations are consistent with further presented calculations that include specific counterions, showing that hybridization between the guest dopant ions and the host polyacetylene chains is unimportant. The lack of guest-host orbital hybridization allows a qualitative rigid band interpretation of the amount of charge transfer for both acceptor and donor doping. For polyacetylene, asymmetry of strain along the chain with respect to the sign of the charge is predicted: negative charge elongates and positive charge shortens the polymer. For charge less than 0.05e per carbon, an approximately linear dependence is obtained for the dependence of chain-direction strain on the amount of injected charge.
Directory of Open Access Journals (Sweden)
Kaihan Fakhar
Full Text Available OBJECTIVE: We aimed in this investigation to study deep brain stimulation (DBS battery drain with special attention directed toward patient symptoms prior to and following battery replacement. BACKGROUND: Previously our group developed web-based calculators and smart phone applications to estimate DBS battery life (http://mdc.mbi.ufl.edu/surgery/dbs-battery-estimator. METHODS: A cohort of 320 patients undergoing DBS battery replacement from 2002-2012 were included in an IRB approved study. Statistical analysis was performed using SPSS 20.0 (IBM, Armonk, NY. RESULTS: The mean charge density for treatment of Parkinson's disease was 7.2 µC/cm(2/phase (SD = 3.82, for dystonia was 17.5 µC/cm(2/phase (SD = 8.53, for essential tremor was 8.3 µC/cm(2/phase (SD = 4.85, and for OCD was 18.0 µC/cm(2/phase (SD = 4.35. There was a significant relationship between charge density and battery life (r = -.59, p<.001, as well as total power and battery life (r = -.64, p<.001. The UF estimator (r = .67, p<.001 and the Medtronic helpline (r = .74, p<.001 predictions of battery life were significantly positively associated with actual battery life. Battery status indicators on Soletra and Kinetra were poor predictors of battery life. In 38 cases, the symptoms improved following a battery change, suggesting that the neurostimulator was likely responsible for symptom worsening. For these cases, both the UF estimator and the Medtronic helpline were significantly correlated with battery life (r = .65 and r = .70, respectively, both p<.001. CONCLUSIONS: Battery estimations, charge density, total power and clinical symptoms were important factors. The observation of clinical worsening that was rescued following neurostimulator replacement reinforces the notion that changes in clinical symptoms can be associated with battery drain.
On the Control of the Fixed Charge Densities in Al2O3-Based Silicon Surface Passivation Schemes.
Simon, Daniel K; Jordan, Paul M; Mikolajick, Thomas; Dirnstorfer, Ingo
2015-12-30
A controlled field-effect passivation by a well-defined density of fixed charges is crucial for modern solar cell surface passivation schemes. Al2O3 nanolayers grown by atomic layer deposition contain negative fixed charges. Electrical measurements on slant-etched layers reveal that these charges are located within a 1 nm distance to the interface with the Si substrate. When inserting additional interface layers, the fixed charge density can be continuously adjusted from 3.5 × 10(12) cm(-2) (negative polarity) to 0.0 and up to 4.0 × 10(12) cm(-2) (positive polarity). A HfO2 interface layer of one or more monolayers reduces the negative fixed charges in Al2O3 to zero. The role of HfO2 is described as an inert spacer controlling the distance between Al2O3 and the Si substrate. It is suggested that this spacer alters the nonstoichiometric initial Al2O3 growth regime, which is responsible for the charge formation. On the basis of this charge-free HfO2/Al2O3 stack, negative or positive fixed charges can be formed by introducing additional thin Al2O3 or SiO2 layers between the Si substrate and this HfO2/Al2O3 capping layer. All stacks provide very good passivation of the silicon surface. The measured effective carrier lifetimes are between 1 and 30 ms. This charge control in Al2O3 nanolayers allows the construction of zero-fixed-charge passivation layers as well as layers with tailored fixed charge densities for future solar cell concepts and other field-effect based devices. PMID:26618751
Energy Technology Data Exchange (ETDEWEB)
Freyer, Benjamin
2013-05-02
This thesis concerns measurements of transient charge density maps by femtosecond X-ray diffraction. Different X-ray diffraction methods will be considered, particularly with regard to their application in femtosecond X-ray diffraction. The rotation method is commonly used in stationary X-ray diffraction. In the work in hand an X-ray diffraction experiment is demonstrated, which combines the method with ultrafast X-ray pulses. This experiment is the first implementation which makes use of the rotation method to map transient intensities of a multitude of Bragg reflections. As a prototype material Bismuth is used, which previously was studied frequently by femtosecond X-ray diffraction by measuring Bragg reflections successively. The experimental results of the present work are compared with the literature data. In the second part a powder-diffraction experiment will be presented, which is used to study the dynamics of the electron-density distribution on ultrafast time scales. The experiment investigates a transition metal complex after photoexcitation of the metal to ligand charge transfer state. Besides expected results, i. e. the change of the bond length between the metal and the ligand and the transfer of electronic charge from the metal to the ligand, a strong contribution of the anion to the charge transfer was found. Furthermore, the charge transfer has predominantly a cooperative character. That is, the excitation of a single complex causes an alteration of the charge density of several neighboring units. The results show that more than 30 transition-metal complexes and 60 anions contribute to the charge transfer. This collective response is a consequence of the strong coulomb interactions of the densely packed ions.
Energy Technology Data Exchange (ETDEWEB)
Gan, Zhaofeng; Gu, Meng; Tang, Jianshi; Wang, Chiu-Yen; He, Yang; Wang, Kang L.; Wang, Chongmin; Smith, David J.; McCartney, Martha R.
2016-06-08
The successful operation of rechargeable batteries relies on reliable insertion/ extraction of ions into/from the electrodes. The battery performance and the response of the electrodes to such ion insertion and extraction are directly related to the spatial distribution of the charge and its dynamic evolution. However, it remains unclear how charge is distributed in the electrodes during normal battery operation. In this work, we have used offaxis electron holography to measure charge distribution during lithium ion insertion into a Ge nanowire (NW) under dynamic operating conditions. We discovered that the surface region of the Ge core is negatively charged during the core-shell lithiation of the Ge NW, which is counterbalanced by positive charge on the inner surface of the lithiated LixGe shell. The remainder of the lithiated LixGe shell is free from net charge, consistent with its metallic characteristics. The present work provides a vivid picture of charge distribution and dynamic evolution during Ge NW lithiation and should form the basis for tackling the response of these and related materials under real electrochemical conditions.
Gan, Zhaofeng; Gu, Meng; Tang, Jianshi; Wang, Chiu-Yen; He, Yang; Wang, Kang L; Wang, Chongmin; Smith, David J; McCartney, Martha R
2016-06-01
The successful operation of rechargeable batteries relies on reliable insertion/extraction of ions into/from the electrodes. The battery performance and the response of the electrodes to such ion insertion and extraction are directly related to the spatial distribution of the charge and its dynamic evolution. However, it remains unclear how charge is distributed in the electrodes during normal battery operation. In this work, we have used off-axis electron holography to measure charge distribution during lithium ion insertion into a Ge nanowire (NW) under dynamic operating conditions. We discovered that the surface region of the Ge core is negatively charged during the core-shell lithiation of the Ge NW, which is counterbalanced by positive charge on the inner surface of the lithiated LixGe shell. The remainder of the lithiated LixGe shell is free from net charge, consistent with its metallic characteristics. The present work provides a vivid picture of charge distribution and dynamic evolution during Ge NW lithiation and should form the basis for tackling the response of these and related materials under real electrochemical conditions. PMID:27192608
Charge-density studies of energetic materials: CL-20 and FOX-7.
Meents, A; Dittrich, B; Johnas, S K J; Thome, V; Weckert, E F
2008-02-01
Experimental electron densities and derived properties have been determined for the two energetic materials CL-20 (3,5,9,11-tetraacetyl-14-oxo-1,3,5,7,9,11-hexaazapentacyclo-[5.5.3.02,6.04,10.08,12]pentadecane), and FOX-7 (1,1-diamino-2,2-dinitroethylene) from single-crystal diffraction. Synchrotron data extending to high scattering angles were measured at low temperature. Low figures-of-merit and excellent residuals were obtained. The Hansen & Coppens multipole-model electron density was compared with results from theoretical calculations via structure factors simulating an experiment. Chemical bonding in the molecules is discussed and a topological analysis gives insight especially into the character of those bonds that are thought to play a key role in the decomposition of the molecules. A comparison of theoretical and experimental electrostatic potentials shows no obvious evidence supporting earlier findings on other nitroheterocyclic molecules that electron-density maxima near the C-NO(2) bonds mapped on the electron-density isosurface can be correlated with impact sensitivities. For FOX-7 periodic Hartree-Fock calculations were performed to investigate the influence of the crystal field on the electron density distribution. PMID:18204210
Charge state distribution studies of the metal vapor vacuum arc ion source
International Nuclear Information System (INIS)
We have studied the charge state distribution of the ion beam produced by the MEVVA (metal vapor vacuum arc) high current metal ion source. Beams produced from a wide range of cathode materials have been examined and the charge state distributions have been measured as a function of many operational parameters. In this paper we review the charge state data we have accumulated, with particular emphasis on the time history of the distribution throughout the arc current pulse duration. We find that in general the spectra remain quite constant throughout most of the beam pulse, so long as the arc current is constant. There is an interesting early-time transient behavior when the arc is first initiated and the arc current is still rising, during which time the ion charge states produced are observed to be significantly higher than during the steady current region that follows. 12 refs., 5 figs
Spatial distribution of ion charges in fast, partially stripped clusters traversing solid targets
International Nuclear Information System (INIS)
Joint statistical description of the distribution of ion charge states and the spatial structure of a cluster, made of heavy ions, allows a self-consistent generalization of the Brandt-Kitagawa variational theory, including dynamically-screened inter-ionic interactions, in a form of a non-linear integral equation. Solution of such an equation for fast clusters passing very thin foils shows the familiar reduction of charge per ion, compared to the charge on an isotactic ion, which is rather non-homogeneously distributed throughout the volume of the cluster. As a consequence, the distribution of individual ion charges in the cluster exhibits large dispersion around an average value, which drops with the increasing cluster size
Spatial distribution of ion charges in fast, partially stripped clusters traversing solid targets
Miskovic, Z L; Goodman, F O; Wang, Y N
2002-01-01
Joint statistical description of the distribution of ion charge states and the spatial structure of a cluster, made of heavy ions, allows a self-consistent generalization of the Brandt-Kitagawa variational theory, including dynamically-screened inter-ionic interactions, in a form of a non-linear integral equation. Solution of such an equation for fast clusters passing very thin foils shows the familiar reduction of charge per ion, compared to the charge on an isotactic ion, which is rather non-homogeneously distributed throughout the volume of the cluster. As a consequence, the distribution of individual ion charges in the cluster exhibits large dispersion around an average value, which drops with the increasing cluster size.
Energy Technology Data Exchange (ETDEWEB)
Feng, Zhenbao; Yang, Bing; Lin, Yangming; Su, Dangsheng, E-mail: dssu@imr.ac.cn [Shenyang National Laboratory of Materials Science, Institute of Metal Research, Chinese Academy of Sciences, Wenhua Road 72, Shenyang 110016 (China)
2015-12-07
The electron momentum distribution of detonation nanodiamonds (DND) was investigated by recording electron energy-loss spectra at large momentum transfer in the transmission electron microscope (TEM), which is known as electron Compton scattering from solid (ECOSS). Compton profile of diamond film obtained by ECOSS was found in good agreement with prior photon experimental measurement and theoretical calculation that for bulk diamond. Compared to the diamond film, the valence Compton profile of DND was found to be narrower, which indicates a more delocalization of the ground-state charge density for the latter. Combining with other TEM characterizations such as high-resolution transmission electron spectroscopy, diffraction, and energy dispersive X-ray spectroscopy measurements, ECOSS was shown to be a great potential technique to study ground-state electronic properties of nanomaterials.
Production of Transverse Controllable Laser Density Distribution in Fermilab/NICADD Photoinjector
Li, Jianliang; Tikhoplav, Rodion
2005-01-01
The Fermilab/NICADD photoinjector laboratory consist of a photoemission electron source based on an L band rf-gun. The CsTe photocathode is illuminated by an ultrashort UV laser. The transport line from the laser to the photocathode was recently upgraded to allow imaging of an object plane located ~20 m from the photocathode. This upgrade allows the generation of transverse laser distributions with controlled nonuniformity, yielding the production of an electron beam with various transverse densities patterns. Measuring the evolution of the artificial pattern on the electron bunch provides information that can be used to benchmark numerical simulations and investigate the impact of space charge. Preliminary data on these investigations are presented in the present paper.
International Nuclear Information System (INIS)
The electron momentum distribution of detonation nanodiamonds (DND) was investigated by recording electron energy-loss spectra at large momentum transfer in the transmission electron microscope (TEM), which is known as electron Compton scattering from solid (ECOSS). Compton profile of diamond film obtained by ECOSS was found in good agreement with prior photon experimental measurement and theoretical calculation that for bulk diamond. Compared to the diamond film, the valence Compton profile of DND was found to be narrower, which indicates a more delocalization of the ground-state charge density for the latter. Combining with other TEM characterizations such as high-resolution transmission electron spectroscopy, diffraction, and energy dispersive X-ray spectroscopy measurements, ECOSS was shown to be a great potential technique to study ground-state electronic properties of nanomaterials
Monte Carlo studies of diamagnetism and charge density wave order in the cuprate pseudogap regime
Hayward Sierens, Lauren; Achkar, Andrew; Hawthorn, David; Melko, Roger; Sachdev, Subir
2015-03-01
The pseudogap regime of the hole-doped cuprate superconductors is often characterized experimentally in terms of a substantial diamagnetic response and, from another point of view, in terms of strong charge density wave (CDW) order. We introduce a dimensionless ratio, R, that incorporates both diamagnetic susceptibility and the correlation length of CDW order, and therefore reconciles these two fundamental characteristics of the pseudogap. We perform Monte Carlo simulations on a classical model that considers angular fluctuations of a six-dimensional order parameter, and compare our Monte Carlo results for R with existing data from torque magnetometry and x-ray scattering experiments on YBa2Cu3O6+x. We achieve qualitative agreement, and also propose future experiments to further investigate the behaviour of this dimensionless ratio.
Evidence for Charge-Density-Wave in Underdoped Bi2201 from ARPES and LEED
Rosen, J. A.; Comin, R.; Levy, G.; Fournier, D.; Zhu, Z.-H.; Ludbrook, B.; Veenstra, C. N.; Wong, D.; Dosanjh, P.; Yoshida, Y.; Eisaki, H.; Petaccia, L.; Damascelli, A.
2012-02-01
While there is mounting evidence for a broken symmetry in the pseudogap state of the high-Tc cuprates, the identification of a specific phase remains elusive. Through the combination of electronic (ARPES) and structural (LEED) probes, we uncover a temperature dependent evolution of the CuO2 plane band dispersion in highly-ordered Bi2201, which is directly associated with a hitherto-undetected evolution of the incommensurate superstructure. The quasilinear, continuous variation of the modulation wavelength 2π/Q2 from ˜ 6 to 43,elow a characteristic TQ2 30,, provides evidence for an electronically-driven charge-density-wave ordering. This points to a remarkable electron-lattice coupling, in which the footprint of the BiO-layer-induced superstructure is found in the modulated electronic structure of the CuO2 plane.
Non-thermal separation of electronic and structural orders in a persisting charge density wave
Porer, M; Ménard, J -M; Dachraoui, H; Mouchliadis, L; Perakis, I E; Heinzmann, U; Demsar, J; Rossnagel, K; Huber, R
2016-01-01
The simultaneous ordering of different degrees of freedom in complex materials undergoing spontaneous symmetry-breaking transitions often involves intricate couplings that have remained elusive in phenomena as wide ranging as stripe formation, unconventional superconductivity or colossal magnetoresistance. Ultrafast optical, x-ray and electron pulses can elucidate the microscopic interplay between these orders by probing the electronic and lattice dynamics separately, but a simultaneous direct observation of multiple orders on the femtosecond scale has been challenging. Here we show that ultrabroadband terahertz pulses can simultaneously trace the ultrafast evolution of coexisting lattice and electronic orders. For the example of a charge-density-wave (CDW) in 1T-TiSe2, we demonstrate that two components of the CDW order parameter - excitonic correlations and a periodic lattice distortion (PLD) - respond very differently to 12-fs optical excitation. Even when the excitonic order of the CDW is quenched, the PL...
Chiral and nonchiral edge states in quantum Hall systems with charge density modulation
Szumniak, Paweł; Klinovaja, Jelena; Loss, Daniel
2016-06-01
We consider a system of weakly coupled wires with quantum Hall effect (QHE) and in the presence of a spatially periodic modulation of the chemical potential along the wire, equivalent to a charge density wave (CDW). We investigate the competition between the two effects which both open a gap. We show that by changing the ratio between the amplitudes of the CDW modulation and the tunneling between wires, one can switch between nontopological CDW-dominated phase to topological QHE-dominated phase. Both phases host edge states of chiral and nonchiral nature robust to on-site disorder. However, only in the topological phase, the edge states are immune to disorder in the phase shifts of the CDWs. We provide analytical solutions for filling factor ν =1 and study numerically effects of disorder as well as present numerical results for higher filling factors.
Possibility of charge density wave transition in a SrPt2Sb2 superconductor.
Ibuka, Soshi; Imai, Motoharu
2016-04-27
The first-order transition at T(0) = 270 K for the platinum-based SrPt2Sb2 superconductor was investigated using x-ray diffraction and magnetic susceptibility measurements. When polycrystalline SrPt2Sb2 was cooled down through T(0), the structure was transformed from monoclinic to a modulated orthorhombic structure, and no magnetic order was formed, which illustrates the possibility of a charge density wave (CDW) transition at T(0). SrPt2Sb2 can thus be a new example to examine the interplay of CDW and superconductivity in addition to SrPt2As2, BaPt2As2, and LaPt2Si2. It is unique that the average structure of the low-temperature phase has higher symmetry than that of the high-temperature phase.
Impurity-Mediated Early Condensation of a Charge Density Wave in an Atomic Wire Array.
Yeom, Han Woong; Oh, Deok Mahn; Wippermann, Stefan; Schmidt, Wolf Gero
2016-01-26
We directly show how impurity atoms induce the condensation of a representative electronic phase, the charge density wave (CDW) phase, in atomic scale with scanning tunneling microscopy. Oxygen impurity atoms on the self-assembled metallic atomic wire array on a silicon crystal condense the CDW locally above the pristine transition temperature. More interestingly, the CDW along the wires is induced not by a single atomic impurity but by the cooperation of multiple impurities. First-principles calculations disclose the mechanism of the cooperation as the coherent superposition of the local lattice strain induced by impurities, stressing the coupled electronic and lattice degrees of freedom for the CDW. This opens the possibility of the strain engineering over electronic phases of atomic-scale systems. PMID:26634634
International Nuclear Information System (INIS)
The Scanning tunneling microscope (STM) has been used to study the effects of Fe doping on the charge-density wave (CDW) structure in NbSe3 and 1T-TaS2. In NbSe3 small amounts of Fe reduce both CDW gaps by 25--30% and change the relative CDW amplitudes of the high and low temperature CDWs. The CDW amplitudes remain strong on all three chains of the surface unit cell with no evident disorder. In 1T-Fe0.05Ta0.95S2 the Fe introduces substantial disorder in the CDW pattern, but the local CDW amplitude remains strong. The CDW energy gap is reduced by approximately 50% and the resistive anomaly at the commensurate-incommensurate transition is removed. The STM in both the image and spectroscopy modes can detect subtle changes in CDW structure due to impurities
Scanning tunneling microscopy of charge-density waves in NbSe3
International Nuclear Information System (INIS)
The charge-density wave (CDW) structure in NbSe3 due to the two independent CDWs has been imaged by scanning tunneling microscopy. As predicted by band structure considerations the CDW modulation is observed to be substantially localized on different chains for the separate CDWs. At 77K where only the high temperature CDW exists a relatively weak modulation with a single component along the /bar b/-axis is observed. At 4.2K the low temperature CDW contributes a much stronger /approximately/4/bar b/0 /times/ 2/rvec c/0 superlattice modulation. The combination of atomic resolution and CDW modulations allows an unambiguous identification of the chain structure to be made. 9 refs., 5 figs
Spin-charge and spin-orbital separations in density-functional theory
Vieira, Daniel
2012-01-01
It is known that the separation of electrons into spinons and chargons, the spin-charge separation, plays a decisive role when describing strongly correlated one-dimensional (1D) Friedel oscillations. Here, we extend the investigation by considering a third electron fractionalization: the separation into spinons and orbitons. Specifically, we deal with two exact constraints of exchange-correlation (XC) density-functionals: (i) The constancy of the highest occupied Kohn-Sham eigenvalues upon fractional electron numbers, and (ii) their discontinuities at integers. By means of 1D Hubbard chains, we show that spin-orbital separation can be decisive when dealing with derivative discontinuities of XC potentials, especially at strong correlations.
Central depressions in the charge density profiles of the nuclei around $^{46}$Ar
Song, Jun Ling; Long, Wen Hui
2015-01-01
The occurrence of the proton bubble-like structure has been studied within the relativistic Hartree-Fock-Bogoliubov (RHFB) and relativistic Hartree-Bogoliubov (RHB) theories by exploring the bulk properties, the charge density profiles and single proton spectra of argon isotopes and $N = 28$ isotones. It is found that the RHFB calculations with PKA1 effective interaction, which can properly reproduce the charge radii of argon isotopes and the $Z=16$ proton shell nearby, do not support the occurrence of the proton bubble-like structure in argon isotopes due to the prediction of deeper bound proton orbit $\\pi2s_{1/2}$ than $\\pi1d_{3/2}$. For $N = 28$ isotones, $^{42}$Si and $^{40}$Mg are predicted by both RHFB and RHB models to have the proton bubble-like structure, owing to the large gap between the proton $\\pi2s_{1/2}$ and $\\pi1d_{5/2}$ orbits, namely the $Z=14$ proton shell. Therefore, $^{42}$Si is proposed as the potential candidate of proton bubble nucleus, which has longer life-time than $^{40}$Mg.
Surface Charge Density Determines the Efficiency of Cationic Gemini Surfactant Based Lipofection
Ryhänen, Samppa J.; Säily, Matti J.; Paukku, Tommi; Borocci, Stefano; Mancini, Giovanna; Holopainen, Juha M.; Kinnunen, Paavo K. J.
2003-01-01
The efficiencies of the binary liposomes composed of 1,2-dimyristoyl-sn-glycero-3-phosphocholine and cationic gemini surfactant, (2S,3R)-2,3-dimethoxy-1,4-bis(N-hexadecyl-N,N-dimethylammonium)butane dibromide as transfection vectors, were measured using the enhanced green fluorescent protein coding plasmid and COS-1 cells. Strong correlation between the transfection efficiency and lipid stoichiometry was observed. Accordingly, liposomes with XSR−1 ≥ 0.50 conveyed the enhanced green fluorescent protein coding plasmid effectively into cells. The condensation of DNA by liposomes with XSR−1 > 0.50 was indicated by static light scattering and ethidium bromide intercalation assay, whereas differential scanning calorimetry and fluorescence anisotropy of diphenylhexatriene revealed stoichiometry dependent reorganization in the headgroup region of the liposome bilayer, in alignment with our previous Langmuir-balance study. Surface charge density and the organization of positive charges appear to determine the mode of interaction of DNA with (2S,3R)-2,3-dimethoxy-1,4-bis(N-hexadecyl-N,N-dimethylammonium)butane dibromide/1,2-dimyristoyl-sn-glycero-3-phosphocholine liposomes, only resulting in DNA condensation when XSR−1 > 0.50. Condensation of DNA in turn seems to be required for efficient transfection. PMID:12524311
Bai, Yang; Liu, Shouping; Jiang, Ping; Zhou, Lei; Li, Jing; Tang, Charles; Verma, Chandra; Mu, Yuguang; Beuerman, Roger W; Pervushin, Konstantin
2009-08-01
Defensins are small (3-5 kDa) cysteine-rich cationic proteins found in both vertebrates and invertebrates constituting the front line of host innate immunity. Despite intensive research, bactericidal and cytotoxic mechanisms of defensins are still largely unknown. Moreover, we recently demonstrated that small peptides derived from defensins are even more potent bactericidal agents with less toxicity toward host cells. In this paper, structures of three C-terminal (R36-K45) analogues of human beta-defensin-3 were studied by 1H NMR spectroscopy and extensive molecular dynamics simulations. Because of indications that these peptides might target the inner bacterial membrane, they were reconstituted in dodecylphosphocholine or dodecylphosphocholine/1-palmitoyl-2-oleoyl-sn-glycero-3-[phospho-rac-(1-glycerol)] mixed micelles, and lipid bicelles mimicking the phospholipid-constituted bilayer membrane of mammalian and bacterial cells. The results show that the binding affinity and partitioning into the lipid phase and the ability to dimerize and accrete well-defined structures upon interactions with lipid membranes contribute to compactization of positive charges within peptide oligomers. The peptide charge density, mediated by corresponding three-dimensional structures, was found to directly correlate with the antimicrobial activity. These novel observations may provide a new rationale for the design of improved antimicrobial agents.
Variation of Charge Distribution and Capacitance on Thin Wire Using the Method of Moments
Directory of Open Access Journals (Sweden)
Mohamed Louzazni
2013-09-01
Full Text Available In this paper, we attempting to determine the linear charge density and capacitance on a finite straight segment of thin charged conducting wire of length L=1 m and radius r. we assume that the charge density piecewise constant over the length and the electric potential are is one volt. If the radius are very small compared to the length r<
International Nuclear Information System (INIS)
In an advanced fusion, fusion-produced charged particles must be separated from each other for efficient energy conversion to electricity. The CuspDEC performs this function of separation and direct energy conversion. Analysis of working characteristics of CuspDEC on plasma density is an important subject. This paper summarizes and discusses experimental and theoretical works for high density plasma by using a small scale experimental device employing a slanted cusp magnetic field. When the incident plasma is low-density, good separation of the charged particles can be accomplished and this is explained by the theory based on a single particle motion. In high density plasma, however, this theory cannot be always applied due to space charge effects. In the experiment, as gradient of the field line increases, separation capability of the charged particles becomes higher. As plasma density becomes higher, however, separation capability becomes lower. This can be qualitatively explained by using calculations of the modified Störmer potential including space charge potential. (author)
The mapping of electronic energy distributions using experimental electron density.
Tsirelson, Vladimir G
2002-08-01
It is demonstrated that the approximate kinetic energy density calculated using the second-order gradient expansion with parameters of the multipole model fitted to experimental structure factors reproduces the main features of this quantity in a molecular or crystal position space. The use of the local virial theorem provides an appropriate derivation of approximate potential energy density and electronic energy density from the experimental (model) electron density and its derivatives. Consideration of these functions is not restricted by the critical points in the electron density and provides a comprehensive characterization of bonding in molecules and crystals. PMID:12149553
The mapping of electronic energy distributions using experimental electron density.
Tsirelson, Vladimir G
2002-08-01
It is demonstrated that the approximate kinetic energy density calculated using the second-order gradient expansion with parameters of the multipole model fitted to experimental structure factors reproduces the main features of this quantity in a molecular or crystal position space. The use of the local virial theorem provides an appropriate derivation of approximate potential energy density and electronic energy density from the experimental (model) electron density and its derivatives. Consideration of these functions is not restricted by the critical points in the electron density and provides a comprehensive characterization of bonding in molecules and crystals.
Influence of the vacuum interface on the charge distribution in V 2 O 3 thin films
Schwingenschlögl, Udo
2009-09-22
The electronic structure of V2O3 thin films is studied by means of the augmented spherical wave method as based on density functional theory and the local density approximation. We establish that the effects of charge redistribution, induced by the vacuum interface, in such films are restricted to a very narrow surface layer of ≈15 Å thickness. As a consequence, charge redistribution can be ruled out as a source of the extraordinary thickness dependence of the metal–insulator transition observed in V2O3 thin films of ~100–1000 Å thickness.
Influence of the vacuum interface on the charge distribution in V2O3 thin films
Schwingenschlögl, U.; Frésard, R.; Eyert, V.
2009-09-01
The electronic structure of V2O3 thin films is studied by means of the augmented spherical wave method as based on density functional theory and the local density approximation. We establish that the effects of charge redistribution, induced by the vacuum interface, in such films are restricted to a very narrow surface layer of ≈15 Å thickness. As a consequence, charge redistribution can be ruled out as a source of the extraordinary thickness dependence of the metal-insulator transition observed in V2O3 thin films of ~100-1000 Å thickness.
Energy Technology Data Exchange (ETDEWEB)
Bodendorfer, M; Wurz, P; Hohl, M, E-mail: bodendorfer@ep.isas.jaxa.j [Space Research and Planetary Sciences, University of Bern, 3012 Bern (Switzerland)
2010-08-15
For the first time, the charge state distribution inside the MEsskammer fuer FlugzeitInStrumente und Time-Of-Flight (MEFISTO) electron cyclotron resonance (ECR) plasma and in the extracted ion beam was successfully simulated. A self-consistent ECR plasma ionization model (Hohl M 2002 MEFISTO II: Design, setup, characterization and operation of an improved calibration facility for solar plasma instrumentation PhD Thesis University of Bern) was further developed, recomputing the ion confinement time for every ion species and in every time step based on the actual plasma potential rather than using a prescribed constant ion confinement time. The simulation starts with a user defined set of initial conditions and develops the problem in time space by an adaptive step length fourth order Runge-Kutta (RK4) solver, considering particle densities based on ionization rates, recombination rates, ion confinement times and plasma potential. At the simulation end, a steady-state ion charge state distribution is reached, which is in excellent agreement with the measured ion beam charge state distribution of the MEFISTO ion source for Ar{sup 1+} to Ar{sup 5+} and in good agreement for Ar{sup 6+}.
Bodendorfer, M.; Wurz, P.; Hohl, M.
2010-08-01
For the first time, the charge state distribution inside the MEsskammer für FlugzeitInStrumente und Time-Of-Flight (MEFISTO) electron cyclotron resonance (ECR) plasma and in the extracted ion beam was successfully simulated. A self-consistent ECR plasma ionization model (Hohl M 2002 MEFISTO II: Design, setup, characterization and operation of an improved calibration facility for solar plasma instrumentation PhD Thesis University of Bern) was further developed, recomputing the ion confinement time for every ion species and in every time step based on the actual plasma potential rather than using a prescribed constant ion confinement time. The simulation starts with a user defined set of initial conditions and develops the problem in time space by an adaptive step length fourth order Runge-Kutta (RK4) solver, considering particle densities based on ionization rates, recombination rates, ion confinement times and plasma potential. At the simulation end, a steady-state ion charge state distribution is reached, which is in excellent agreement with the measured ion beam charge state distribution of the MEFISTO ion source for Ar1+ to Ar5+ and in good agreement for Ar6+.
Imaging the local density of free charge carriers in doped InAs nanowires
Energy Technology Data Exchange (ETDEWEB)
Hauer, Benedikt; Taubner, Thomas [I. Institute of Physics (1A), RWTH Aachen Univerity, Sommerfeldstrasse 14, 52074 Aachen (Germany); Sladek, Kamil; Haas, Fabian; Schaepers, Thomas; Hardtdegen, Hilde [Peter Gruenberg Institute (PGI-9), Forschungszentrum Juelich, 52425 Juelich (Germany)
2013-07-01
Semiconductor nanowires are promising candidates for future nanoelectronic devices. While the bottom-up approach for their growth could simplify the device fabrication, their quantitative characterization remains challenging. We use scattering-type scanning near-field optical microscopy (s-SNOM) to investigate the local density of free electrons in Si-doped InAs nanowires grown by selective-area metalorganic vapor phase epitaxy (SA-MOVPE). In s-SNOM the evanescent electric field at the apex of an illuminated tip is used to probe a sample at a strongly sub-wavelength resolution. This method is highly sensitive to variations in the sample permittivity around Re(ε) ∼ -2. The use of tunable mid-infrared lasers therefore allows addressing the plasma frequency of free charge carriers in highly doped nanowires. Here, we demonstrate that the sensitivity of s-SNOM is sufficient to detect a slight unintended variation in the carrier concentration during the growth process. Furthermore, using model calculations, we give an estimate of the local density of free electrons.
Superconductivity in Pd-intercalated charge-density-wave rare earth poly-tellurides RETe n
He, J. B.; Wang, P. P.; Yang, H. X.; Long, Y. J.; Zhao, L. X.; Ma, C.; Yang, M.; Wang, D. M.; Shangguan, X. C.; Xue, M. Q.; Zhang, P.; Ren, Z. A.; Li, J. Q.; Liu, W. M.; Chen, G. F.
2016-06-01
Charge density waves (CDWs) are periodic modulations of the conduction electron density in solids, which are generally considered to remove electrons from the Fermi level, and thus preclude a superconducting state. However, in a variety of CDW materials, such as the prototypical transition metal chalcogenides, superconductivity has also been observed at very low temperature (Yokoya et al 2001 Science 294 2518; Morosan et al 2006 Nat. Phys. 2 544; Kiss et al 2007 Nat. Phys. 3 720), in which, although the two electronic correlated states are believed to occur in different parts of Fermi surface sheets derived mainly from chalcogen p-states and transition metal d-states, the nature of the relationship between them has not yet been unambiguously determined. Here we report the discovery of superconductivity in Pd-intercalated RETe n (RE = rare earth; n = 2.5, 3) CDW systems, in which the chalcogen layers alone are responsible for both superconductivity and CDW instability. Our finding could provide an ideal model system for comprehensive study of the interplay between CDW and superconductivity due to the remarkable simplicity of the electronic structure of Te planes.
Institute of Scientific and Technical Information of China (English)
Li Cheng-Bin; Li Ming-Kai; Yin Dong; Liu Fu-Qing; Fan Xiang-Jun
2005-01-01
A first principles study of the electronic properties and bulk modulus (B0) of the fcc and bcc transition metals,transition metal carbides and nitrides is presented. The calculations were performed by plane-wave pseudopotential method in the framework of the density functional theory with local density approximation. The density of states and the valence charge densities of these solids are plotted. The results show that B0 does not vary monotonically when the number of the valence d electrons increases. B0 reaches a maximum and then decreases for each of the four sorts of solids. It is related to the occupation of the bonding and anti-bonding states in the solid. The value of the valence charge density at the midpoint between the two nearest metal atoms tends to be proportional to B0.
International Nuclear Information System (INIS)
The origin of total ionizing dose induced dark current in CMOS image sensors is investigated by comparing dark current measurements to interface state density and trapped charge density measurements. Two types of photodiode and several thick-oxide-FETs were manufactured using a 0.18-μm CMOS image sensor process and exposed to 10-keV X-ray from 3 krad to 1 Mrad. It is shown that the radiation induced trapped charge extends the space charge region at the oxide interface, leading to an enhancement of interface state SRH generation current. Isochronal annealing tests show that STI interface states anneal out at temperature lower than 100 C whereas about a third of the trapped charge remains after 30 min at 300 C. (authors)
Charged-particle pseudorapidity distributions in Au+Au collisions at sNN=62.4 GeV
Back, B. B.; Baker, M. D.; Ballintijn, M.; Barton, D. S.; Betts, R. R.; Bickley, A. A.; Bindel, R.; Busza, W.; Carroll, A.; Chai, Z.; Decowski, M. P.; García, E.; Gburek, T.; George, N.; Gulbrandsen, K.; Halliwell, C.; Hamblen, J.; Hauer, M.; Henderson, C.; Hofman, D. J.; Hollis, R. S.; Hołyński, R.; Holzman, B.; Iordanova, A.; Johnson, E.; Kane, J. L.; Khan, N.; Kulinich, P.; Kuo, C. M.; Lin, W. T.; Manly, S.; Mignerey, A. C.; Nouicer, R.; Olszewski, A.; Pak, R.; Reed, C.; Roland, C.; Roland, G.; Sagerer, J.; Seals, H.; Sedykh, I.; Smith, C. E.; Stankiewicz, M. A.; Steinberg, P.; Stephans, G. S. F.; Sukhanov, A.; Tonjes, M. B.; Trzupek, A.; Vale, C.; Nieuwenhuizen, G. J. Van; Vaurynovich, S. S.; Verdier, R.; Veres, G. I.; Wenger, E.; Wolfs, F. L. H.; Wosiek, B.; Woźniak, K.; Wysłouch, B.
2006-08-01
The charged-particle pseudorapidity density for Au+Au collisions at sNN=62.4 GeV has been measured over a wide range of impact parameters and compared to results obtained at other energies. As a function of collision energy, the pseudorapidity distribution grows systematically both in height and width. The midrapidity density is found to grow approximately logarithmically between BNL Alternating Gradient Synchrotron (AGS) energies and the top BNL Relativistic Heavy Ion Collider (RHIC) energy. There is also an approximate factorization of the centrality and energy dependence of the midrapidity yields. The new results at sNN=62.4 GeV confirm the previously observed phenomenon of “extended longitudinal scaling” in the pseudorapidity distributions when viewed in the rest frame of one of the colliding nuclei. It is also found that the evolution of the shape of the distribution with centrality is energy independent, when viewed in this reference frame. As a function of centrality, the total charged particle multiplicity scales linearly with the number of participant pairs as it was observed at other energies.
Energy Technology Data Exchange (ETDEWEB)
Guilbaud, Maxime
2013-05-02
We present the measurement of the charged-particle pseudorapidity (η) density distribution, (dN{sub ch})/(dη) , for a number of centrality bins in Pb–Pb collisions at √(s{sub NN})=2.76TeV over a wide pseudorapidity range. Using the innermost pixel layers of the ALICE tracking system and the ALICE forward detectors (VZERO and FMD), we cover the pseudorapidity range: −5<η<5.5. The analysis is performed using a dedicated technique utilizing the collisions with LHC ‘satellite’ bunches. These collisions have displaced vertices in the range −187.5
Energy Technology Data Exchange (ETDEWEB)
Reshak, A.H., E-mail: maalidph@yahoo.co.uk [New Technologies – Research Center, University of West Bohemia, Univerzitni 8, 306 14 Pilsen (Czech Republic); Center of Excellence Geopolymer and Green Technology, School of Material Engineering, University Malaysia Perlis, 01007 Kangar, Perlis (Malaysia); Kamarudin, H. [Center of Excellence Geopolymer and Green Technology, School of Material Engineering, University Malaysia Perlis, 01007 Kangar, Perlis (Malaysia); Alahmed, Z.A. [Department of Physics and Astronomy, King Saud University, Riyadh 11451 (Saudi Arabia); Auluck, S. [CSIR-National Physical Laboratory, Dr. K S Krishnan Marg, New Delhi 110012 (India); Chyský, Jan [Department of Instrumentation and Control Engineering, Faculty of Mechanical Engineering, CTU in Prague, Technicka 4, 166 07 Prague 6 (Czech Republic)
2014-06-01
A comprehensive theoretical density functional investigation of the electronic crystal structure, chemical bonding, and the electron charge densities of 9-Methyl-3-Thiophen-2-YI-Thieno [3, 2-e] [1, 2, 4] Thriazolo [4,3-c] Pyrimidine-8-Carboxylic Acid Ethyl Ester (C{sub 15}H{sub 12}N{sub 4}O{sub 2}S{sub 2}) is performed. The density of states at Fermi level equal to 5.50 (3.45) states/Ry cell, and the calculated bare electronic specific heat coefficient is found to be 0.95 (0.59) mJ/mole-K{sup 2} for the local density approximation (Engel–Vosko generalized gradient approximation). The electronic charge density space distribution contours in (1 0 0) and (1 1 0) planes were calculated. We find that there are two independent molecules (A and B) in the asymmetric unit exhibit intramolecular C–H…O, C–H…N interactions. This intramolecular interaction is different in molecules A and B, where A molecule show C–H…O interaction while B molecule exhibit C–H…N interaction. We should emphasis that there is π–π interaction between the pyrimidine rings of the two neighbors B molecules gives extra strengths and stabilizations to the superamolecular structure. The calculated distance between the two neighbors pyrimidine rings found to be 3.345 Å, in good agreement with the measured one (3.424(1) Å). - Highlights: • Electronic structure, chemical bonding, and electron charge density were studied. • Density of states at Fermi level is 5.50 (3.45) states/Ry cell, for LDA (EVGGA). • Bare electronic specific heat coefficient is 0.95 (0.59) mJ/mole-K{sup 2} for LDA(EVGGA). • There are two independent molecules (A and B) in the asymmetric unit.
Qian, Yibin; Ren, Zhongzhou; Ni, Dongdong
2016-08-01
We further investigate the cluster emission from heavy nuclei beyond the lead region in the framework of the preformed cluster model. The refined cluster-core potential is constructed by the double-folding integral of the density distributions of the daughter nucleus and the emitted cluster, where the radius or the diffuseness parameter in the Fermi density distribution formula is determined according to the available experimental data on the charge radii and the neutron skin thickness. The Schrödinger equation of the cluster-daughter relative motion is then solved within the outgoing Coulomb wave-function boundary conditions to obtain the decay width. It is found that the present decay width of cluster emitters is clearly enhanced as compared to that in the previous case, which involved the fixed parametrization for the density distributions of daughter nuclei and clusters. Among the whole procedure, the nuclear deformation of clusters is also introduced into the calculations, and the degree of its influence on the final decay half-life is checked to some extent. Moreover, the effect from the bubble density distribution of clusters on the final decay width is carefully discussed by using the central depressed distribution.
A Generalization of Abel Inversion to non axisymmetric density distribution
Tomassini, P
2001-01-01
Abel Inversion is currently used in laser-plasma studies in order to estimate the electronic density $n_e$ from the phase-shift map $\\delta \\phi$ obtained via interferometry. The main limitation of the Abel method is due to the assumption of axial symmetry of the electronic density, which is often hardly fulfilled. In this paper we present an improvement to the Abel inversion technique in which the axial symmetry condition is relaxed by means of a truncated Legendre Polinomial expansion in the azimutal angle. With the help of simulated interferograms, we will show that the generalized Abel inversion generates accurate densities maps when applied to non axisymmetric density sources.
DEFF Research Database (Denmark)
Marra, Francesco; Træholt, Chresten; Larsen, Esben
2012-01-01
A great interest is recently paid to Electric Vehicles (EV) and their integration into electricity grids. EV can potentially play an important role in power system operation, however, the EV charging infrastructures have been only partly defined, considering them as limited to individual charging...... points, randomly distributed into the networks. This paper addresses the planning of public central charging stations (CCS) that can be integrated in low-voltage (LV) networks for EV parallel charging. The concepts of AC and DC architectures of CCS are proposed and a comparison is given...... on their investment cost. Investigation on location and size of CCS is conducted, analyzing two LV grids of different capacity. The results enlighten that a public CCS should be preferably located in the range of 100 m from the transformer. The AC charging levels of 11 kW and 22 kW have the highest potential in LV...
Highly transverse velocity distribution of convoy electrons emitted by highly charged ions
Seliger, M.; Tőkési, K.; Reinhold, C. O.; Burgdörfer, J.
2003-05-01
We present a theoretical study of convoy electron emission resulting from highly charged ion (HCI) transport through carbon foils. Employing a classical transport theory we analyze the angular and energy distribution formed by multiple scattering of electrons in the solid. We find that the convoy electron distribution becomes highly transverse at intermediate foil thicknesses representing an oblate spheroidal distribution due to the stepwise excitation of the HCI. The calculated convoy electron spectra are found to be in good agreement with recent measurements.
Energy Technology Data Exchange (ETDEWEB)
Bracken, D.S.; Foxford, E.R.; Kwiatkowski, K. [and others
1995-10-01
Moving source fits have been performed for IMFs as a function of observables related to collision violence in the 1.8-4.8 GeV {sup 3}He +{sup nat}Ag, {sup l97}Au reactions. The systematic behavior of the source properties and fragment charge distributions will be reviewed. The evolution of the spectral Coulomb parameters provides evidence for nuclear expansion prior to multifragmentation, suggesting a breakup density of p/p{sub o} {approximately} 1/3. The charge distributions will be examined in terms of power-law fits and moment analyses.
Fragment charge and energy distributions in the 1.8-4.8 GeV 3He + natAg, 197Au reactions
International Nuclear Information System (INIS)
Moving source fits have been performed for IMFs as a function of observables related to collision violence in the 1.8-4.8 GeV 3He +natAg, l97Au reactions. The systematic behavior of the source properties and fragment charge distributions will be reviewed. The evolution of the spectral Coulomb parameters provides evidence for nuclear expansion prior to multifragmentation, suggesting a breakup density of p/po ∼ 1/3. The charge distributions will be examined in terms of power-law fits and moment analyses
Sikler, Ferenc
2012-01-01
The energy loss distribution of charged particles in silicon is approximated by a simple analytical parametrization. Its use is demonstrated through several examples. With the help of energy deposits in sensing elements of the detector, the position of track segments and the corresponding deposited energy are estimated with improved accuracy and less bias. The parametrization is successfully used to estimate the energy loss rate of charged particles, and it is applied to detector gain calibration tasks.
Recoil ion charge state distribution following the beta(sup +) decay of {sup 21}Na
Energy Technology Data Exchange (ETDEWEB)
Scielzo, Nicholas D.; Freedman, Stuart J.; Fujikawa, Brian K.; Vetter, Paul A.
2003-01-03
The charge state distribution following the positron decay of 21Na has been measured, with a larger than expected fraction of the daughter 21Ne in positive charge states. No dependence on either the positron or recoil nucleus energy is observed. The data is compared to a simple model based on the sudden approximation. Calculations suggest a small but important contribution from recoil ionization has important consequences for precision beta decay correlation experiments detecting recoil ions.
Role of Molecular Weight Distribution on Charge Transport in Semiconducting Polymers
Himmelberger, Scott
2014-10-28
© 2014 American Chemical Society. Model semiconducting polymer blends of well-controlled molecular weight distributions are fabricated and demonstrated to be a simple method to control intermolecular disorder without affecting intramolecular order or degree of aggregation. Mobility measurements exhibit that even small amounts of low molecular weight material are detrimental to charge transport. Trends in charge carrier mobility can be reproduced by a simple analytical model which indicates that carriers have no preference for high or low molecular weight chains and that charge transport is limited by interchain hopping. These results quantify the role of long polymer tie-chains and demonstrate the need for controlled polydispersity for achieving high carrier mobilities.
Effects of charge distribution on water filling process in carbon nanotube
Institute of Scientific and Technical Information of China (English)
MENG LingYi; LI QiKai; SHUAI ZhiGang
2009-01-01
Using umbrella sampling technique with molecular dynamics simulation, we investigated the nanoflu-idic transport of water in carbon nanotube (CNT). The simulations showed that a positive charge modi-fication to the carbon nanotube can slow down the water column growth process, while the negative charge modification to the carbon nanotube will, on the other hand, quicken the water column growth process. The free energy curves were obtained through the statistical process of water column growth under different charge distributions, and the results indicated that these free energy curves can be employed to explain the dynamical process of water column growth in the nanosized channels.
Effects of charge distribution on water filling process in carbon nanotube
Institute of Scientific and Technical Information of China (English)
无
2009-01-01
Using umbrella sampling technique with molecular dynamics simulation,we investigated the nanoflu-idic transport of water in carbon nanotube(CNT).The simulations showed that a positive charge modi-fication to the carbon nanotube can slow down the water column growth process,while the negative charge modification to the carbon nanotube will,on the other hand,quicken the water column growth process.The free energy curves were obtained through the statistical process of water column growth under different charge distributions,and the results indicated that these free energy curves can be employed to explain the dynamical process of water column growth in the nanosized channels.
The Impact of Charging Plug-In Hybrid Electric Vehicles on a Residential Distribution Grid
Clement-Nyns, Kristien; Haesen, Edwin; Driesen, Johan
2010-01-01
Alternative vehicles, such as plug-in hybrid electric vehicles, are becoming more popular. The batteries of these plug-in hybrid electric vehicles are to be charged at home from a standard outlet or on a corporate car park. These extra electrical loads have an impact on the distribution grid which is analyzed in terms of power losses and voltage deviations. Without coordination of the charging, the vehicles are charged instantaneously when they are plugged in or after a fixed start delay. Thi...
Strain Tuning of the Charge Density Wave in Monolayer and Bilayer 1T-TaS2
Gan, Liyong
2015-12-07
By first-principles calculations, we investigate the strain effects on the charge density wave states of monolayer and bilayer 1T-TaS2. The modified stability of the charge density wave in the monolayer is understood in terms of the strain dependent electron localization, which determines the distortion amplitude. On the other hand, in the bilayer the effect of strain on the interlayer interaction is also crucial. The rich phase diagram under strain opens new venues for applications of 1T-TaS2. We interpret the experimentally observed insulating state of bulk 1T-TaS2 as inherited from the monolayer by effective interlayer decoupling.
Microscopic theory of charges density wave instability in NbSe2
International Nuclear Information System (INIS)
The microscopic theory of Sinha and Harmon for electronically driven lattice instabilities is used to explain the ''Kohn-like'' anomalies in the Σ1 phonon branch and the observed incommensurate superlattice Bragg peak in 2H-NbSe2, characteristic of the charge density wave at low temperatures in the neutron scattering experiments of Moncton et al. In accordance with the APW and LCAO band-structure calculations of Mattheiss of 2H-NbSe2, the presence of three narrow d bands of atomic symmetry xy, x2-y2 and 3z2-r2 at the Fermi level is assumed. Thus the conduction-band wave function is represented by a linear combination of tight-binding Gaussian atomic orbitals with neglect of the variation of the radial wave function across the bands. The screened electron-ion interaction and the Coulomb energy of the charge fluctuation on the d shells of Nb atoms is represented by a pseudopotential screened by the Lindhard dielectric function. The phonon eigenvectors needed for estimating the electron-phonon interaction were calculated using a simple force constant model. In agreement with the experimental results, it was found that the phonon frequencies for the Σ1 and Σ3 branches are very strongly renormalized as one approaches the zone boundary. By introducing the electronic relaxation effects a central peak appears at the q vector of the instability and the actual phonon renormalization is partially suppressed. This explains the superlattice Bragg peaks observed at low temperatures and ''Kohn-like'' anomalies in the Σ1 phonon branch of NbSe2
Jackman, T. M.; Morgan, S. R.; Barest, G. D.; Morgan, E. F.
2015-01-01
Summary This study's goal was to determine associations among the intravertebral heterogeneity in bone density, bone strength, and intervertebral disc (IVD) health. Results indicated that predictions of vertebral strength can benefit from considering the magnitude of the density heterogeneity and the congruence between the spatial distribution of density and IVD health. Introduction This study aims to determine associations among the intravertebral heterogeneity in bone density, bone strength, and IVD health Methods Regional measurements of bone density were performed throughout 30 L1 vertebral bodies using microcomputed tomography (μCT) and quantitative computed tomography (QCT). The magnitude of the intravertebral heterogeneity in density was defined as the interquartile range and quartile coefficient of variation in regional densities. The spatial distribution of density was quantified using ratios of regional densities representing different anatomical zones (e.g., anterior to posterior regional densities). Cluster analysis was used to identify groups of vertebrae with similar spatial distributions of density. Vertebral strength was measured in compression. IVD health was assessed using two scoring systems. Results QCT- and μCT-based measures of the magnitude of the intravertebral heterogeneity in density were strongly correlated with each other (p<0.005). Accounting for the interquartile range in regional densities improved predictions of vertebral strength as compared to predictions based only on mean density (R2=0.59 vs. 0.43; F-test p-value=0.018). Specifically, after adjustment for mean density, vertebral bodies with greater heterogeneity in density exhibited higher strength. No single spatial distribution of density was associated with high vertebral strength. Analyses of IVD scores suggested that the health of the adjacent IVDs may modulate the effect of a particular spatial distribution of density on vertebral strength. Conclusions Noninvasive
Ding, Mingnan; Liang, Yihao; Xing, Xiangjun
2016-10-01
In this work, we explore the statistical physics of colloidal particles that interact with electrolytes via ion-specific interactions. Firstly we study particles interacting weakly with electrolyte using linear response theory. We find that the mean potential around a particle is linearly determined by the effective charge distribution of the particle, which depends both on the bare charge distribution and on ion-specific interactions. We also discuss the effective interaction between two such particles and show that, in the far field regime, it is bilinear in the effective charge distributions of two particles. We subsequently generalize the above results to the more complicated case where particles interact strongly with the electrolyte. Our results indicate that in order to understand the statistical physics of non-dilute electrolytes, both ion-specific interactions and ionic correlations have to be addressed in a single unified and consistent framework. Project supported by the National Natural Science Foundation of China (Grant Nos. 11174196 and 91130012).
Hierarchical charge distribution controls self-assembly process of silk in vitro
Zhang, Yi; Zhang, Cencen; Liu, Lijie; Kaplan, David L.; Zhu, Hesun; Lu, Qiang
2015-12-01
Silk materials with different nanostructures have been developed without the understanding of the inherent transformation mechanism. Here we attempt to reveal the conversion road of the various nanostructures and determine the critical regulating factors. The regulating conversion processes influenced by a hierarchical charge distribution were investigated, showing different transformations between molecules, nanoparticles and nanofibers. Various repulsion and compressive forces existed among silk fibroin molecules and aggregates due to the exterior and interior distribution of charge, which further controlled their aggregating and deaggregating behaviors and finally formed nanofibers with different sizes. Synergistic action derived from molecular mobility and concentrations could also tune the assembly process and final nanostructures. It is suggested that the complicated silk fibroin assembly processes comply a same rule based on charge distribution, offering a promising way to develop silk-based materials with designed nanostructures.
Kappatou, A.; Jaspers, R. J. E.; Delabie, E.; Marchuk, O.; Biel, W.; Jakobs, M. A.
2012-10-01
Investigation of impurity transport properties in tokamak plasmas is essential and a diagnostic that can provide information on the impurity content is required. Combining charge exchange recombination spectroscopy (CXRS) and beam emission spectroscopy (BES), absolute radial profiles of impurity densities can be obtained from the CXRS and BES intensities, electron density and CXRS and BES emission rates, without requiring any absolute calibration of the spectra. The technique is demonstrated here with absolute impurity density radial profiles obtained in TEXTOR plasmas, using a high efficiency charge exchange spectrometer with high etendue, that measures the CXRS and BES spectra along the same lines-of-sight, offering an additional advantage for the determination of absolute impurity densities.
Energy Technology Data Exchange (ETDEWEB)
Kappatou, A.; Delabie, E. [FOM Institute DIFFER - Dutch Institute for Fundamental Energy Research, Association EURATOM-FOM, 3430 BE Nieuwegein (Netherlands); Jaspers, R. J. E.; Jakobs, M. A. [Science and Technology of Nuclear Fusion, Eindhoven University of Technology, 5600 MB Eindhoven (Netherlands); Marchuk, O.; Biel, W. [Institute for Energy and Climate Research, Forschungszentrum Julich GmbH, Trilateral Euregio Cluster, 52425 Julich (Germany)
2012-10-15
Investigation of impurity transport properties in tokamak plasmas is essential and a diagnostic that can provide information on the impurity content is required. Combining charge exchange recombination spectroscopy (CXRS) and beam emission spectroscopy (BES), absolute radial profiles of impurity densities can be obtained from the CXRS and BES intensities, electron density and CXRS and BES emission rates, without requiring any absolute calibration of the spectra. The technique is demonstrated here with absolute impurity density radial profiles obtained in TEXTOR plasmas, using a high efficiency charge exchange spectrometer with high etendue, that measures the CXRS and BES spectra along the same lines-of-sight, offering an additional advantage for the determination of absolute impurity densities.
Yu, Deyang; Liu, Junliang; Xue, Yingli; Zhang, Mingwu; Cai, Xiaohong; Hu, Jianjun; Dong, Jinmei; Li, Xin
2015-11-01
A 128-channel picoammeter system is constructed based on instrumentation amplifiers. Taking advantage of a high electric potential and narrow bandwidth in DC energetic charged beam measurements, a current resolution better than 5 fA can be achieved. Two sets of 128-channel strip electrodes are implemented on printed circuit boards and are employed for ion and electron beam current distribution measurements. Tests with 60 keV O3+ ions and 2 keV electrons show that it can provide exact boundaries when a positive charged particle beam current distribution is measured.
International Nuclear Information System (INIS)
Longitudinal density correlations of produced matter in Au+Au collisions at √(sNN)=200 GeV have been measured from the inclusive charged particle distributions as a function of pseudorapidity window sizes. The extracted αξ parameter, related to the susceptibility of the density fluctuations in the long-wavelength limit, exhibits a nonmonotonic behavior as a function of the number of participant nucleons, Npart. A local maximum is seen at Npart∼90, with corresponding energy density based on the Bjorken picture of εBjτ∼2.4 GeV/(fm2c) with a transverse area size of 60 fm2. This behavior may suggest a critical phase boundary based on the Ginzburg-Landau framework
Airapetian, A; Akopov, Z; Andrus, A; Aschenauer, E C; Augustyniak, W; Avakian, R; Avetisian, A; Avetissian, E; Belostotskii, S; Bianchi, N; Blok, H P; Bttcher, H; Bonomo, C; Borisov, A; Brüll, A; Bryzgalov, V; Burns, J; Capiluppi, M; Capitani, G P; Cisbani, E; Ciullo, G; Contalbrigo, M; Dalpiaz, P F; Deconinck, W; De Leo, R; Demey, M; De Nardo, L; De Sanctis, E; Diefenthaler, M; Di Nezza, P; Dreschler, J; Düren, M; Ehrenfried, M; Elalaoui-Moulay, A; Elbakian, G; Ellinghaus, F; Elschenbroich, U; Fabbri, R; Fantoni, A; Felawka, L; Frullani, S; Funel, A; Gabbert, D; Gapienko, G; Gapienko, V; Garibaldi, F; Gavrilov, G; Karibian, V; Giordano, F; Gliske, S; Gregor, I M; Guler, H; Hadjidakis, C; Hasch, D; Hasegawa, T; Hesselink, W H A; Hill, G; Hillenbrand, A; Hoek, M; Holler, Y; Hommez, B; Hristova, I; Iarygin, G; Imazu, Y; Ivanilov, A; Izotov, A; Jackson, H E; Jgoun, A; Joosten, S; Kaiser, R; Keri, T; Kinney, E; Kiselev, A; Kobayashi, T; Kopytin, M; Korotkov, V; Kozlov, V; Kravchenko, P; Krivokhizhin, V G; Lagamba, L; Lamb, R; Lapikas, L; Lehmann, I; Lenisa, P; Liebing, P; Linden-Levy, L A; Lopez Ruiz, A; Lorenzon, W; Lu, S; Lu, X R; Ma, B Q; Mahon, D; Maiheu, B; Makins, N C R; Manfr, L; Mao, Y; Marianski, B; Marukyan, H; Mexner, V; Miller, C A; Miyachi, Y; Muccifora, V; Murray, M; Mussgiller, A; Nagaitsev, A; Nappi, E; Naryshkin, Yu; Nass, A; Negodaev, M; Nowak, W D; Osborne, A; Pappalardo, L L; Perez-Benito, R; Pickert, N; Raithel, M; Reggiani, D; Reimer, P E; Reischl, A; Reolon, A R; Riedl, C; Rith, K; Rock, S E; Rosner, G; Rostomyan, A; Rubacek, L; Rubin, J; Ryckbosch, D; Salomatin, Y; Sanjiev, I; Schäfer, A; Schnell, G; Schüler, K P; Seitz, B; Shearer, C; Shibata, T A; Shutov, V; Stancari, M; Statera, M; Steffens, E; Steijger, J J M; Stenzel, H; Stewart, J; Stinzing, F; Streit, J; Tait, P; Taroian, S; Tchuiko, B; Terkulov, A; Trzcinski, A; Tytgat, M; Vandenbroucke, A; Van der Nat, P B; van der Steenhoven, G; Van Haarlem, Y; van Hulse, C; Varanda, M; Veretennikov, D; Vikhrov, V; Vilardi, I; Vogel, C; Wang, S; Yaschenko, S; Ye, H; Ye, Y; Ye, Z; Yen, S; Yu, W; Zeiler, D; Zihlmann, B; Zupranski, P
2008-01-01
The momentum and helicity density distributions of the strange quark sea in the nucleon are obtained in leading order from charged-kaon production in deep-inelastic scattering on the deuteron. The distributions are extracted from spin-averaged K+/- multiplicities, and from K+/- and inclusive double-spin asymmetries for scattering of polarized positrons by a polarized deuterium target. The shape of the momentum distribution is softer than that of the average of the ubar and dbar quarks. In the region of measurement, the helicity distribution is zero within experimental uncertainties.
Magnetic field controlled charge density wave coupling in underdoped YBa2Cu3O6+x
DEFF Research Database (Denmark)
Chang, J.; Blackburn, E.; Ivashko, O.;
2016-01-01
The application of magnetic fields to layered cuprates suppresses their high-temperature superconducting behaviour and reveals competing ground states. In widely studied underdoped YBa2Cu3O6+x (YBCO), the microscopic nature of field-induced electronic and structural changes at low temperatures...... at B∼15 T. The CDW signal along the a-direction is also enhanced by field, but does not develop an additional pattern of correlations. Magnetic field modifies the coupling between the CuO2 bilayers in the YBCO structure, and causes the sudden appearance of the 3D CDW order. The mirror symmetry...... remains unclear. Here we report an X-ray study of the high-field charge density wave (CDW) in YBCO. For hole dopings ∼ 0.123, we find that a field (B∼10 T) induces additional CDW correlations along the CuO chain (b-direction) only, leading to a three-dimensional (3D) ordered state along this direction...
First-principles studies on the charge density wave in uranium
Qiu, Ruizhi; Lu, Haiyan; Ao, Bingyun; Tang, Tao; Chen, Piheng
2016-06-01
The charge density wave (CDW) state of α-U (called {α1} -U) was studied through a first-principles total-energy minimization using the conjugate gradient algorithm. The optimized crystal structure of {α1} -U was found to have the space group Pbnm, which was proposed in the earlier Landau-type theory and is isostructural with the α-Np structure. In particular, the changes in the lattice parameters of Pbnm-U with respect to α-U are consistent with the experimental observations. In addition, the energetic stability of Pbnm-U with respect to α-U was confirmed by enthalpy calculations, and the value of the critical pressure in the pressure-induced quantum transition from Pbnm-U to α-U is in good agreement with the experimental result. Moreover, the phonon calculation verified the dynamical instability of α-U and the stability of Pbnm-U. Finally, the calculated electronic structures exhibit features of the CDW state.
Magnetic field controlled charge density wave coupling in underdoped YBa2Cu3O6+x
Chang, J.; Blackburn, E.; Ivashko, O.; Holmes, A. T.; Christensen, N. B.; Hücker, M.; Liang, Ruixing; Bonn, D. A.; Hardy, W. N.; Rütt, U.; Zimmermann, M. V.; Forgan, E. M.; Hayden, S. M.
2016-05-01
The application of magnetic fields to layered cuprates suppresses their high-temperature superconducting behaviour and reveals competing ground states. In widely studied underdoped YBa2Cu3O6+x (YBCO), the microscopic nature of field-induced electronic and structural changes at low temperatures remains unclear. Here we report an X-ray study of the high-field charge density wave (CDW) in YBCO. For hole dopings ~0.123, we find that a field (B~10 T) induces additional CDW correlations along the CuO chain (b-direction) only, leading to a three-dimensional (3D) ordered state along this direction at B~15 T. The CDW signal along the a-direction is also enhanced by field, but does not develop an additional pattern of correlations. Magnetic field modifies the coupling between the CuO2 bilayers in the YBCO structure, and causes the sudden appearance of the 3D CDW order. The mirror symmetry of individual bilayers is broken by the CDW at low and high fields, allowing Fermi surface reconstruction, as recently suggested.
Three-dimensional charge density wave order in YBCO at high magnetic field
Lee, Wei-Sheng
Charge density wave (CDW) correlations have been shown to universally exist in cuprate superconductors. However, their nature at high magnetic fields, e . g . inferred from nuclear magnetic resonance, Hall coefficient, and sound velocity measurements, is distinct from that measured by x-ray scattering at zero and low fields. In this talk, I will discuss our recent experiment which combines a pulsed magnet with an x-ray free electron laser to characterize the CDW in YBa2Cu3O6.67 via x-ray scattering in fields up to 28 Tesla. While the zero-field CDW order, which develops below ~150 K, is essentially two dimensional, a three-dimensionally ordered CDW emerges at magnetic fields beyond 15 Tesla and at temperatures below the zero-field superconducting transition temperature. While the two CDW arrange differently along the c-axis, they share the same incommensurate periodicity in the CuO2plane. Our observations imply that the two forms of CDW and high-temperature superconductivity are intimately linked.
Magnetic fields produced by rotating symmetrical bodies with homogeneous surface charge density
Espejel-Morales, R.; Murguía-Romero, G.; Calles, A.; Cabrera-Bravo, E.; Morán-López, J. L.
2016-07-01
We present a numerical calculation for the stationary magnetic field produced by different rotating bodies with homogeneous and constant surface charge density. The calculation is done by superposing the magnetic field produced by a set of loops of current which mimic the magnetic field produced by belts of current defined by slices of fixed width. We consider the cases of a sphere, ellipsoids, open and closed cylinders and a combination of these in a dumbbell-like shell. We also plot their magnetic field lines using a technique that make use of the Runge–Kutta fourth-order method. Up to our knowledge, the case of closed cylinders was not calculated before. In contrast to previous results, we find that the magnetic field inside finite hollow bodies is homogeneous only in the case of a sphere. This is consequence of the fact that, for the sphere, the surface of any slice taken perpendicularly to the rotation axis, depends only on its thickness, like in the case of an infinite cylinder.
Shekhar, Himanshu; Tzabari, Lior; Solomeshch, Olga; Tessler, Nir
2016-10-01
We have investigated the influence of the active layer thickness on the balance of the internal mechanisms affecting the efficiency of copper phthalocyanine - fullerene (C60) based vacuum deposited bulk heterojunction organic photocell. We fabricated a range of devices for which we varied the thickness of the active layer from 40 to 120 nm and assessed their performance using optical and electrical characterization techniques. As reported previously for phthalocyanine:C60, the performance of the device is highly dependent on the active layer thickness and of all the thicknesses we tried, the 40 nm thin active layer device showed the best solar cell characteristic parameters. Using the transfer matrix based optical model, which includes interference effects, we calculated the optical power absorbed in the active layers for the entire absorption band, and we found that this cannot explain the trend with thickness. Measurement of the cell quantum efficiency as a function of light intensity showed that the relative weight of the device internal processes changes when going from 40 nm to 120 nm thick active layer. Electrical modeling of the device, which takes different internal processes into account, allowed to quantify the changes in the processes affecting the generation - recombination balance. Sub gap external quantum efficiency and morphological analysis of the surface of the films agree with the model's result. We found that as the thickness grows the density of charge transfer states and of dark carriers goes up and the uniformity in the vertical direction is reduced.
Direct observation of many-body charge density oscillations in a two-dimensional electron gas
Sessi, Paolo; Silkin, Vyacheslav M.; Nechaev, Ilya A.; Bathon, Thomas; El-Kareh, Lydia; Chulkov, Evgueni V.; Echenique, Pedro M.; Bode, Matthias
2015-10-01
Quantum interference is a striking manifestation of one of the basic concepts of quantum mechanics: the particle-wave duality. A spectacular visualization of this effect is the standing wave pattern produced by elastic scattering of surface electrons around defects, which corresponds to a modulation of the electronic local density of states and can be imaged using a scanning tunnelling microscope. To date, quantum-interference measurements were mainly interpreted in terms of interfering electrons or holes of the underlying band-structure description. Here, by imaging energy-dependent standing-wave patterns at noble metal surfaces, we reveal, in addition to the conventional surface-state band, the existence of an `anomalous' energy band with a well-defined dispersion. Its origin is explained by the presence of a satellite in the structure of the many-body spectral function, which is related to the acoustic surface plasmon. Visualizing the corresponding charge oscillations provides thus direct access to many-body interactions at the atomic scale.
Novel charge density wave transition in crystals of R5Ir4Si10
Indian Academy of Sciences (India)
S Ramakrishnan
2002-05-01
We review the observation of novel charge density wave (CDW) transitions in ternary R5Ir4Si10 compounds. A high quality single crystal of Lu5Ir4Si10 shows the formation of a commensurate CDW along -axis below 80 K in the (ℎ, 0, ) plane that coexists with BCS type superconductivity below 3.9 K. However, in a single crystal of Er5Ir4Si10, one observes the development of a 1D-incommensurate CDW at 155 K, which then locks into a purely commensurate state below 55 K. The well-localized Er3 moments are antiferromagnetically ordered below 2.8 K which results in the coexistence of strongly coupled CDW with local moment antiferromagnetism in Er5Ir4Si10. Unlike conventional CDW systems, extremely sharp transition (width ∼ 1.5 K) in all bulk properties along with huge heat capacity anomalies in these compounds makes this CDW transition an interesting one.
Dust charging processes with a Cairns-Tsallis distribution function with negative ions
Energy Technology Data Exchange (ETDEWEB)
Abid, A. A., E-mail: abidaliabid1@hotmail.com [Applied Physics Department, Federal Urdu University of Arts, Science and Technology, Islamabad Campus, Islamabad 45320 (Pakistan); Khan, M. Z., E-mail: mzk-qau@yahoo.com [Applied Physics Department, Federal Urdu University of Arts, Science and Technology, Islamabad Campus, Islamabad 45320 (Pakistan); Plasma Technology Research Center, Department of Physics, Faculty of Science, University of Malaya, Kuala Lumpur 50603 (Malaysia); Yap, S. L. [Plasma Technology Research Center, Department of Physics, Faculty of Science, University of Malaya, Kuala Lumpur 50603 (Malaysia); Terças, H., E-mail: hugo.tercas@tecnico.ul.pt [Physics of Information Group, Instituto de Telecomunicações, Av. Rovisco Pais, Lisbon 1049-001 (Portugal); Mahmood, S. [Science Place, University of Saskatchewan, Saskatoon, Saskatchewan S7N5A2 (Canada)
2016-01-15
Dust grain charging processes are presented in a non-Maxwellian dusty plasma following the Cairns-Tsallis (q, α)–distribution, whose constituents are the electrons, as well as the positive/negative ions and negatively charged dust grains. For this purpose, we have solved the current balance equation for a negatively charged dust grain to achieve an equilibrium state value (viz., q{sub d} = constant) in the presence of Cairns-Tsallis (q, α)–distribution. In fact, the current balance equation becomes modified due to the Boltzmannian/streaming distributed negative ions. It is numerically found that the relevant plasma parameters, such as the spectral indexes q and α, the positive ion-to-electron temperature ratio, and the negative ion streaming speed (U{sub 0}) significantly affect the dust grain surface potential. It is also shown that in the limit q → 1 the Cairns-Tsallis reduces to the Cairns distribution; for α = 0 the Cairns-Tsallis distribution reduces to pure Tsallis distribution and the latter reduces to Maxwellian distribution for q → 1 and α = 0.
Dust charging processes with a Cairns-Tsallis distribution function with negative ions
International Nuclear Information System (INIS)
Dust grain charging processes are presented in a non-Maxwellian dusty plasma following the Cairns-Tsallis (q, α)–distribution, whose constituents are the electrons, as well as the positive/negative ions and negatively charged dust grains. For this purpose, we have solved the current balance equation for a negatively charged dust grain to achieve an equilibrium state value (viz., qd = constant) in the presence of Cairns-Tsallis (q, α)–distribution. In fact, the current balance equation becomes modified due to the Boltzmannian/streaming distributed negative ions. It is numerically found that the relevant plasma parameters, such as the spectral indexes q and α, the positive ion-to-electron temperature ratio, and the negative ion streaming speed (U0) significantly affect the dust grain surface potential. It is also shown that in the limit q → 1 the Cairns-Tsallis reduces to the Cairns distribution; for α = 0 the Cairns-Tsallis distribution reduces to pure Tsallis distribution and the latter reduces to Maxwellian distribution for q → 1 and α = 0
Nature of charge density waves and superconductivity in 1 T -TaSe2 -xTex
Liu, Y.; Shao, D. F.; Li, L. J.; Lu, W. J.; Zhu, X. D.; Tong, P.; Xiao, R. C.; Ling, L. S.; Xi, C. Y.; Pi, L.; Tian, H. F.; Yang, H. X.; Li, J. Q.; Song, W. H.; Zhu, X. B.; Sun, Y. P.
2016-07-01
Transition-metal dichalcogenides (TMDs) M X2 (M =Ti,Nb,Ta;X =S,Se,Te) exhibit a rich set of charge density wave (CDW) orders, which usually coexist and/or compete with superconductivity. The mechanisms of CDWs and superconductivity in TMDs are still under debate. Here we perform an investigation on a typical TMD system, 1 T -TaSe2 -xTex (0 ≤x ≤2 ). Doping-induced disordered distribution of Se/Te suppresses CDWs in 1 T -TaSe2. A domelike superconducting phase with the maximum Tconset of 2.5 K was observed near CDWs. The superconducting volume is very small inside the CDW phase and becomes very large instantly when the CDW phase is fully suppressed. The observations can be understood based on the strong q -dependent electron-phonon coupling-induced periodic-lattice-distortion (PLD) mechanism of CDWs. The volume variation of superconductivity implies the emergence of domain walls in the suppressing process of CDWs. Our concluded scenario makes a fundamental understanding about CDWs and related superconductivity in TMDs.
Charge-exchange measurements of fully-stripped oxygen and carbon ion radial density profiles in TFR
International Nuclear Information System (INIS)
Fully-ionized oxygen and carbon ions have been detected in TFR via charge-exchange recombination spectroscopy using a modulated auxiliary neutral beam, thus allowing their radial density profiles to be obtained. An impurity transport numerical code is then used to deduce the impurity transport parameters
Charge and current density profiles of a degenerate magnetized free-electron gas near a hard wall
M.M. Kettenis; L.G. Suttorp
1998-01-01
The charge and current densities of a completely degenerate free-electron gas in a uniform magnetic field are found to have a damped oscillatory spatial dependence near a wall that is parallel to the magnetic field. For large distances from the wall the behaviour of the associated profile functions
Measurements of the charged particle multiplicity distribution in restricted rapidity intervals
Buskulic, Damir; De Bonis, I; Décamp, D; Ghez, P; Goy, C; Lees, J P; Lucotte, A; Minard, M N; Odier, P; Pietrzyk, B; Ariztizabal, F; Chmeissani, M; Crespo, J M; Efthymiopoulos, I; Fernández, E; Fernández-Bosman, M; Gaitan, V; Garrido, L; Martínez, M; Orteu, S; Pacheco, A; Padilla, C; Palla, Fabrizio; Pascual, A; Perlas, J A; Sánchez, F; Teubert, F; Colaleo, A; Creanza, D; De Palma, M; Farilla, A; Gelao, G; Girone, M; Iaselli, Giuseppe; Maggi, G; Maggi, M; Marinelli, N; Natali, S; Nuzzo, S; Ranieri, A; Raso, G; Romano, F; Ruggieri, F; Selvaggi, G; Silvestris, L; Tempesta, P; Zito, G; Huang, X; Lin, J; Ouyang, Q; Wang, T; Xie, Y; Xu, R; Xue, S; Zhang, J; Zhang, L; Zhao, W; Bonvicini, G; Cattaneo, M; Comas, P; Coyle, P; Drevermann, H; Engelhardt, A; Forty, Roger W; Frank, M; Hagelberg, R; Harvey, J; Jacobsen, R; Janot, P; Jost, B; Knobloch, J; Lehraus, Ivan; Markou, C; Martin, E B; Mato, P; Meinhard, H; Minten, Adolf G; Miquel, R; Oest, T; Palazzi, P; Pater, J R; Pusztaszeri, J F; Ranjard, F; Rensing, P E; Rolandi, Luigi; Schlatter, W D; Schmelling, M; Schneider, O; Tejessy, W; Tomalin, I R; Venturi, A; Wachsmuth, H W; Wiedenmann, W; Wildish, T; Witzeling, W; Wotschack, J; Ajaltouni, Ziad J; Bardadin-Otwinowska, Maria; Barrès, A; Boyer, C; Falvard, A; Gay, P; Guicheney, C; Henrard, P; Jousset, J; Michel, B; Monteil, S; Montret, J C; Pallin, D; Perret, P; Podlyski, F; Proriol, J; Rossignol, J M; Saadi, F; Fearnley, Tom; Hansen, J B; Hansen, J D; Hansen, J R; Hansen, P H; Nilsson, B S; Kyriakis, A; Simopoulou, Errietta; Siotis, I; Vayaki, Anna; Zachariadou, K; Blondel, A; Bonneaud, G R; Brient, J C; Bourdon, P; Passalacqua, L; Rougé, A; Rumpf, M; Tanaka, R; Valassi, Andrea; Verderi, M; Videau, H L; Candlin, D J; Parsons, M I; Focardi, E; Parrini, G; Corden, M; Delfino, M C; Georgiopoulos, C H; Jaffe, D E; Antonelli, A; Bencivenni, G; Bologna, G; Bossi, F; Campana, P; Capon, G; Chiarella, V; Felici, G; Laurelli, P; Mannocchi, G; Murtas, F; Murtas, G P; Pepé-Altarelli, M; Dorris, S J; Halley, A W; ten Have, I; Knowles, I G; Lynch, J G; Morton, W T; O'Shea, V; Raine, C; Reeves, P; Scarr, J M; Smith, K; Smith, M G; Thompson, A S; Thomson, F; Thorn, S; Turnbull, R M; Becker, U; Braun, O; Geweniger, C; Graefe, G; Hanke, P; Hepp, V; Kluge, E E; Putzer, A; Rensch, B; Schmidt, M; Sommer, J; Stenzel, H; Tittel, K; Werner, S; Wunsch, M; Beuselinck, R; Binnie, David M; Cameron, W; Colling, D J; Dornan, Peter J; Konstantinidis, N P; Moneta, L; Moutoussi, A; Nash, J; San Martin, G; Sedgbeer, J K; Stacey, A M; Dissertori, G; Girtler, P; Kneringer, E; Kuhn, D; Rudolph, G; Bowdery, C K; Brodbeck, T J; Colrain, P; Crawford, G; Finch, A J; Foster, F; Hughes, G; Sloan, Terence; Whelan, E P; Williams, M I; Galla, A; Greene, A M; Kleinknecht, K; Quast, G; Raab, J; Renk, B; Sander, H G; Wanke, R; Zeitnitz, C; Aubert, Jean-Jacques; Bencheikh, A M; Benchouk, C; Bonissent, A; Bujosa, G; Calvet, D; Carr, J; Diaconu, C A; Etienne, F; Thulasidas, M; Nicod, D; Payre, P; Rousseau, D; Talby, M; Abt, I; Assmann, R W; Bauer, C; Blum, Walter; Brown, D; Dietl, H; Dydak, Friedrich; Ganis, G; Gotzhein, C; Jakobs, K; Kroha, H; Lütjens, G; Lutz, Gerhard; Männer, W; Moser, H G; Richter, R H; Rosado-Schlosser, A; Settles, Ronald; Seywerd, H C J; Stierlin, U; Saint-Denis, R; Wolf, G; Alemany, R; Boucrot, J; Callot, O; Cordier, A; Courault, F; Davier, M; Duflot, L; Grivaz, J F; Jacquet, M; Kim, D W; Le Diberder, F R; Lefrançois, J; Lutz, A M; Musolino, G; Nikolic, I A; Park, H J; Park, I C; Schune, M H; Simion, S; Veillet, J J; Videau, I; Abbaneo, D; Azzurri, P; Bagliesi, G; Batignani, G; Bettarini, S; Bozzi, C; Calderini, G; Carpinelli, M; Ciocci, M A; Ciulli, V; Dell'Orso, R; Fantechi, R; Ferrante, I; Foà, L; Forti, F; Giassi, A; Giorgi, M A; Gregorio, A; Ligabue, F; Lusiani, A; Marrocchesi, P S; Messineo, A; Rizzo, G; Sanguinetti, G; Sciabà, A; Spagnolo, P; Steinberger, Jack; Tenchini, Roberto; Tonelli, G; Triggiani, G; Vannini, C; Verdini, P G; Walsh, J; Betteridge, A P; Blair, G A; Bryant, L M; Cerutti, F; Gao, Y; Green, M G; Johnson, D L; Medcalf, T; Mir, M; Perrodo, P; Strong, J A; Bertin, V; Botterill, David R; Clifft, R W; Edgecock, T R; Haywood, S; Edwards, M; Maley, P; Norton, P R; Thompson, J C; Bloch-Devaux, B; Colas, P; Duarte, H; Emery, S; Kozanecki, Witold; Lançon, E; Lemaire, M C; Locci, E; Marx, B; Pérez, P; Rander, J; Renardy, J F; Rosowsky, A; Roussarie, A; Schuller, J P; Schwindling, J; Si Mohand, D; Trabelsi, A; Vallage, B; Johnson, R P; Kim, H Y; Litke, A M; McNeil, M A; Taylor, G; Beddall, A; Booth, C N; Boswell, R; Cartwright, S L; Combley, F; Dawson, I; Köksal, A; Letho, M; Newton, W M; Rankin, C; Thompson, L F; Böhrer, A; Brandt, S; Cowan, G D; Feigl, E; Grupen, Claus; Lutters, G; Minguet-Rodríguez, J A; Rivera, F; Saraiva, P; Smolik, L; Stephan, F; Apollonio, M; Bosisio, L; Della Marina, R; Giannini, G; Gobbo, B; Ragusa, F; Rothberg, J E; Wasserbaech, S R; Armstrong, S R; Bellantoni, L; Elmer, P; Feng, Z; Ferguson, D P S; Gao, Y S; González, S; Grahl, J; Harton, J L; Hayes, O J; Hu, H; McNamara, P A; Nachtman, J M; Orejudos, W; Pan, Y B; Saadi, Y; Schmitt, M; Scott, I J; Sharma, V; Turk, J; Walsh, A M; Wu Sau Lan; Wu, X; Yamartino, J M; Zheng, M; Zobernig, G
1995-01-01
Charged particle multiplicity distributions have been measured with the ALEPH detector in restricted rapidity intervals |Y| \\leq 0.5,1.0, 1.5,2.0\\/ along the thrust axis and also without restriction on rapidity. The distribution for the full range can be parametrized by a log-normal distribution. For smaller windows one finds a more complicated structure, which is understood to arise from perturbative effects. The negative-binomial distribution fails to describe the data both with and without the restriction on rapidity. The JETSET model is found to describe all aspects of the data while the width predicted by HERWIG is in significant disagreement.
Antila, Hanne S; Salonen, Emppu
2015-04-15
The Thole induced point dipole model is combined with three different point charge fitting methods, Merz-Kollman (MK), charges from electrostatic potentials using a grid (CHELPG), and restrained electrostatic potential (RESP), and two multipole algorithms, distributed multipole analysis (DMA) and Gaussian multipole model (GMM), which can be used to describe the electrostatic potential (ESP) around molecules in molecular mechanics force fields. This is done to study how the different methods perform when intramolecular polarizability contributions are self-consistently removed from the fitting done in the force field parametrization. It is demonstrated that the polarizable versions of the partial charge models provide a good compromise between accuracy and computational efficiency in describing the ESP of small organic molecules undergoing conformational changes. For the point charge models, the inclusion of polarizability reduced the the average root mean square error of ESP over the test set by 4-10%.
Papoulia, A.; Carlsson, B. G.; Ekman, J.
2016-10-01
Atomic spectral lines from different isotopes display a small shift in energy, commonly referred to as the line isotope shift. One of the components of the isotope shift is the field shift, which depends on the extent and the shape of the nuclear charge density distribution. The purpose of this work is to investigate how sensitive field shifts are with respect to variations in the nuclear size and shape and what information of nuclear charge distributions can be extracted from measurements. Nuclear properties are obtained from nuclear density functional theory calculations based on the Skyrme-Hartree-Fock-Bogoliubov approach. These results are combined with multiconfiguration Dirac-Hartree-Fock methods to obtain realistic field shifts and it is seen that phenomena such as nuclear deformation and variations in the diffuseness of nuclear charge distributions give measurable contributions to the isotope shifts. Using a different approach, we demonstrate the possibility to extract information concerning the nuclear charge densities from the observed field shifts. We deduce that combining methods used in atomic and nuclear structure theory gives an improved description of field shifts and that extracting additional nuclear information from measured isotope shifts is possible in the near future with improved experimental methods.
International Nuclear Information System (INIS)
The experimental determination of the spatial distribution of charged particles along the ion-optical axis in electron cyclotron resonance ion sources (ECRIS) defines the focus of this thesis. The spatial distributions of different ion species were obtained in the object plane of the bending magnet (∼45 cm downstream from the plasma electrode) and in the plane of the plasma electrode itself, both in high spatial resolution. The results show that each of the different ion species forms a bloated, triangular structure in the aperture of the plasma electrode. The geometry and the orientation of these structures are defined by the superposition of the radial and axial magnetic fields. The radial extent of each structure is defined by the charge of the ion. Higher charge states occupy smaller, more concentrated structures. The total current density increases towards the center of the plasma electrode. The circular and star-like structures that can be observed in the beam profiles of strongly focused, extracted ion beams are each dominated by ions of a single charge state. In addition, the spatially resolved current density distribution of charged particles in the plasma chamber that impinge on the plasma electrode was determined, differentiating between ions and electrons. The experimental results of this work show that the electrons of the plasma are strongly connected to the magnetic field lines in the source and thus spatially well confined in a triangular-like structure. The intensity of the electrons increases towards the center of the plasma electrode and the plasma chamber, as well. These electrons are surrounded by a spatially far less confined and less intense ion population. All the findings mentioned above were already predicted in parts by simulations of different groups. However, the results presented within this thesis represent the first (and by now only) direct experimental verification of those predictions and are qualitatively transferable to other
Energy Technology Data Exchange (ETDEWEB)
Panitzsch, Lauri
2013-02-08
The experimental determination of the spatial distribution of charged particles along the ion-optical axis in electron cyclotron resonance ion sources (ECRIS) defines the focus of this thesis. The spatial distributions of different ion species were obtained in the object plane of the bending magnet ({approx}45 cm downstream from the plasma electrode) and in the plane of the plasma electrode itself, both in high spatial resolution. The results show that each of the different ion species forms a bloated, triangular structure in the aperture of the plasma electrode. The geometry and the orientation of these structures are defined by the superposition of the radial and axial magnetic fields. The radial extent of each structure is defined by the charge of the ion. Higher charge states occupy smaller, more concentrated structures. The total current density increases towards the center of the plasma electrode. The circular and star-like structures that can be observed in the beam profiles of strongly focused, extracted ion beams are each dominated by ions of a single charge state. In addition, the spatially resolved current density distribution of charged particles in the plasma chamber that impinge on the plasma electrode was determined, differentiating between ions and electrons. The experimental results of this work show that the electrons of the plasma are strongly connected to the magnetic field lines in the source and thus spatially well confined in a triangular-like structure. The intensity of the electrons increases towards the center of the plasma electrode and the plasma chamber, as well. These electrons are surrounded by a spatially far less confined and less intense ion population. All the findings mentioned above were already predicted in parts by simulations of different groups. However, the results presented within this thesis represent the first (and by now only) direct experimental verification of those predictions and are qualitatively transferable to
Institute of Scientific and Technical Information of China (English)
杨忠志; 王长生
2000-01-01
Based on the density functional theory and the atom-bond electronegativity equalization model (ABEEM), a method is proposed to construct the softness matrix and to obtain the electron population normal modes (PNMs) for a closed system. Using this method the information about the bond charge polarization in a molecule can be obtained easily. The test calculation shows that the PNM obtained by this method includes all the modes about the bond charge polarization explicitly. And the bond charge polarization mode characterized by the biggest eigenvalue, which is the softest one of all modes related with chemical bonds, can describe the charge polarization process in a molecule as exquisitely as the corresponding ab initio method.
De Bock, M.; Jakubowska, K.; Hellermann, M. von; Jaspers, R.; Donné, A. J. H.; Shmaenok, L.
2004-10-01
Two techniques are presented that allow us to measure impurity density profiles in the TEXTOR tokamak plasma. The one-dimensional profiles are gathered by charge exchange recombination spectroscopy (CXRS) in combination with beam emission spectroscopy (BES). Combining CXRS and BES eliminate the need for absolute calibration. For two-dimensional profiles an ultrasoft x-ray tomography system has been developed. The system is spectrally resolved and produces local emissivity profiles of several ionization stages of impurities. Both systems are presently being commissioned. They are complementary and give an insight into the impurity distribution and transport in plasmas.
Charge-density analysis of an iron-sulfur protein at an ultra-high resolution of 0.48 Å.
Hirano, Yu; Takeda, Kazuki; Miki, Kunio
2016-06-01
The fine structures of proteins, such as the positions of hydrogen atoms, distributions of valence electrons and orientations of bound waters, are critical factors for determining the dynamic and chemical properties of proteins. Such information cannot be obtained by conventional protein X-ray analyses at 3.0-1.5 Å resolution, in which amino acids are fitted into atomically unresolved electron-density maps and refinement calculations are performed under strong restraints. Therefore, we usually supplement the information on hydrogen atoms and valence electrons in proteins with pre-existing common knowledge obtained by chemistry in small molecules. However, even now, computational calculation of such information with quantum chemistry also tends to be difficult, especially for polynuclear metalloproteins. Here we report a charge-density analysis of the high-potential iron-sulfur protein from the thermophilic purple bacterium Thermochromatium tepidum using X-ray data at an ultra-high resolution of 0.48 Å. Residual electron densities in the conventional refinement are assigned as valence electrons in the multipolar refinement. Iron 3d and sulfur 3p electron densities of the Fe4S4 cluster are visualized around the atoms. Such information provides the most detailed view of the valence electrons of the metal complex in the protein. The asymmetry of the iron-sulfur cluster and the protein environment suggests the structural basis of charge storing on electron transfer. Our charge-density analysis reveals many fine features around the metal complex for the first time, and will enable further theoretical and experimental studies of metalloproteins. PMID:27279229
Charge symmetry breaking from a chiral extrapolation of moments of quark distribution functions
Shanahan, P. E.; Thomas, A. W.; Young, R.D.(ARC Centre of Excellence for Particle Physics at the Terascale and CSSM, School of Chemistry and Physics, University of Adelaide, Adelaide, SA 5005, Australia)
2013-01-01
We present a determination, from lattice QCD, of charge symmetry violation in the spin- independent and spin-dependent parton distribution functions of the nucleon. This is done by chirally extrapolating recent QCDSF/UKQCD Collaboration lattice simulations of the first several Mellin moments of the parton distribution functions of octet baryons to the physical point. We find small chiral corrections for the polarized moments, while the corrections are quantitatively significant in the unpolar...
Scaled momentum distributions of charged particles in dijet photoproduction at HERA
Energy Technology Data Exchange (ETDEWEB)
Chekanov, S.; Derrick, M.; Magill, S. [Argonne National Lab., Argonne, IL (US)] (and others)
2009-04-15
The scaled momentum distributions of charged particles in jets have been measured for dijet photoproduction with the ZEUS detector at HERA using an integrated luminosity of 359 pb{sup -1}. The distributions are compared to predictions based on perturbative QCD carried out in the framework of the modified leading-logarithmic approximation (MLLA) and assuming local parton-hadron duality (LPHD). The universal MLLA scale, {lambda}{sub eff}, and the LPHD parameter, {kappa}{sup ch}, are extracted. (orig.)
Origin of charge density at LaAlO3-on-SrTiO3 heterointerfacespossibility of intrinsic doping
Energy Technology Data Exchange (ETDEWEB)
Siemons, W.
2010-04-29
As discovered by Ohtomo et al., a large sheet charge density with high mobility exists at the interface between SrTiO{sub 3} and LaAlO{sub 3}. Based on transport, spectroscopic and oxygen-annealing experiments, we conclude that extrinsic defects in the form of oxygen vacancies introduced by the pulsed laser deposition process used by all researchers to date to make these samples is the source of the large carrier densities. Annealing experiments show a limiting carrier density. We also present a model that explains the high mobility based on carrier redistribution due to an increased dielectric constant.
Hydroacoustic Estimates of Fish Density Distributions in Cougar Reservoir, 2011
Energy Technology Data Exchange (ETDEWEB)
Ploskey, Gene R.; Zimmerman, Shon A.; Hennen, Matthew J.; Batten, George W.; Mitchell, T. D.
2012-09-01
Day and night mobile hydroacoustic surveys were conducted once each month from April through December 2011 to quantify the horizontal and vertical distributions of fish throughout Cougar Reservoir, Lane County, Oregon.
Preparation and Charge Density in (Co, Fe)-Doped La-Ca-Based Chromite
Saravanan, R.; Thenmozhi, N.; Fu, Yen-Pei
2016-08-01
Transition metal-doped lanthanum chromites (La0.8Ca0.2)(Cr0.9- x Co0.1Fe x )O3 ( x = 0.03, 0.06, 0.09, 0.12) have been synthesized by solid state reaction method. The synthesized samples were characterized for their structural properties using powder x-ray diffraction analysis, which shows that the grown samples are orthorhombic in structure with single phase. The nature of bonding and the charge distribution of the grown samples have been analyzed by maximum entropy method. Further, the samples were characterized for their optical and magnetic properties using ultraviolet-visible spectra and vibrating sample magnetometry. The microstructural studies were carried by scanning electron microscopy/electron dispersive x-ray spectroscopy techniques. From the optical absorption spectra, it was found that the energy band gap of the samples ranges from 2.135 eV to 2.405 eV. From vibrating sample magnetometer measurements, ferromagnetic like behaviour with large coercive field was observed for Fe doping concentration of x = 0.12. Since the doped lanthanum chromites have good mechanical properties and electrical conductivity at high temperature, these materials are used in solid oxide fuel cells.
Dirac-Fock atomic electronic structure calculations using different nuclear charge distributions
Visscher, L; Dyall, KG
1997-01-01
Numerical Hartree-Fock calculations based on the Dirac-Coulomb Hamiltonian for the first 109 elements of the periodic table are presented. The results give the total electronic energy, as a function of the nuclear model that is used, for four different models of the nuclear charge distribution. The
Polarized parton distributions from charged-current deep-inelastic scattering
International Nuclear Information System (INIS)
We investigate the capabilities of a neutrino factory in the determination of polarized parton distributions from charged-current deep-inelastic scattering experiments, with special attention to the accuracy of this kind of measurements. We show that a neutrino factory would allow to distinguish between different theoretical scenarios for the proton spin structure
Importance of volume corrections on the net-charge distributions at the RHIC BES energies
Xu, Hao-jie
2016-01-01
The paper presents my recent investigations of volume corrections on the cumulant products of net-charge distributions in statistical model, corresponding to the data reported by the STAR collaboration. The corrected statistical expectations, under simple Poisson approximations, can reasonably explain the data measured in experiment. The results indicate that volume corrections play crucial role in event-by-event multiplicity fluctuation studies.
Market-based coordinated charging of electric vehicles on the low-voltage distribution grid
M. Ghijsen; R D'hulst
2011-01-01
This paper presents a market based coordination mechanism for charging electric vehicles. In market based coordination, a virtual market is used to match supply and demand of a commodity. The goal is to limit the impact of the electric vehicles on the low voltage distribution grid. First it is shown
Ghasemi, S. Alireza; Hofstetter, Albert; Saha, Santanu; Goedecker, Stefan
2015-01-01
Based on an analysis of the short range chemical environment of each atom in a system, standard machine learning based approaches to the construction of interatomic potentials aim at determining directly the central quantity which is the total energy. This prevents for instance an accurate description of the energetics of systems where long range charge transfer is important as well as of ionized systems. We propose therefore not to target directly with machine learning methods the total ener...
Tanaka, Kiyoaki; Elkaim, E.; Li, Liang; Jue, Zhu Nai; Coppens, P.; Landrum, J.; タナカ, キヨアキ; 田中, 清明; Tanaka, K
1986-01-01
The electron density distribution in crystals of (meso‐tetraphenylporphinato)iron(II) has been analyzed using accurate x‐ray diffraction data collected at 120 K. The structural results are in agreement with those of the room temperature study. Theoretical calculations predict several different ground states for the complex and in particular support the 3A2g and the 3EgA states. The experimental electron density distribution shows large peaks above and below the iron atom which would not be pr...
Directory of Open Access Journals (Sweden)
J. Adam
2016-02-01
Full Text Available The pseudorapidity (η and transverse-momentum (pT distributions of charged particles produced in proton–proton collisions are measured at the centre-of-mass energy s=13 TeV. The pseudorapidity distribution in |η|<1.8 is reported for inelastic events and for events with at least one charged particle in |η|<1. The pseudorapidity density of charged particles produced in the pseudorapidity region |η|<0.5 is 5.31±0.18 and 6.46±0.19 for the two event classes, respectively. The transverse-momentum distribution of charged particles is measured in the range 0.15
Formal Difference Analysis and Unification on p-Norm Distribution Density Functions
Institute of Scientific and Technical Information of China (English)
LIU Zhengcai; ZHU Jianjun; WANG Huaiyu
2006-01-01
The cause of the formal difference of p-norm distribution density functions is analyzed, two problems in the deduction of p-norm formulating are improved, and it is proved that two different forms of p-norm distribution density functions are equivalent. This work is useful for popularization and application of the p-norm theory to surveying and mapping.
10 CFR 960.5-2-1 - Population density and distribution.
2010-01-01
..., when issued by the NRC, in 10 CFR part 60, subpart I, “Emergency Planning Criteria.” ... 10 Energy 4 2010-01-01 2010-01-01 false Population density and distribution. 960.5-2-1 Section 960... Population density and distribution. (a) Qualifying condition. The site shall be located such that,...
Sharma, Prashant
2015-01-01
Charge state distributions of $^{56}$Fe and $^{58}$Ni projectile ions passing through thin carbon foils have been studied in the energy range of 1.44 - 2.69 MeV/u using a novel method from the x-ray spectroscopy technique. Interestingly the charge state distribution in the bulk show Lorentzian behavior instead of usual Gaussian distribution. Further, different parameters of charge state distribution like mean charge state, distribution width and asymmetric parameter are determined and compared with the empirical calculations and ETACHA predictions. It is found that the x-ray measurement technique is appropriate to determine the mean charge state right at the interaction zone or in the bulk. Interestingly, empirical formalism predicts much lower projectile mean charge states compare to x-ray measurements which clearly indicate multi-electron capture from the target surface. The ETACHA predictions and experimental results are found to be comparable for energies $\\geq$ 2 MeV/u.
Multiple charge density wave transitions in the antiferromagnets R NiC2 (R =Gd ,Tb)
Shimomura, S.; Hayashi, C.; Hanasaki, N.; Ohnuma, K.; Kobayashi, Y.; Nakao, H.; Mizumaki, M.; Onodera, H.
2016-04-01
X-ray scattering and electrical resistivity measurements were performed on GdNiC2 and TbNiC2. We found a set of satellite peaks characterized by q1=(0.5 ,η ,0 ) below T1, at which the resistivity shows a sharp inflection, suggesting the charge density wave (CDW) formation. The value of η decreases with decreasing temperature below T1, and then a transition to a commensurate phase with q1 C=(0.5 ,0.5 ,0 ) takes place. The diffuse scattering observed above T1 indicates the presence of soft phonon modes associated with CDW instabilities at q1 and q2=(0.5 ,0.5 ,0.5 ) . The long-range order given by q2 is developed in addition to that given by q1 C in TbNiC2, while the short-range correlation with q2 persists even at 6 K in GdNiC2. The amplitude of the q1 C lattice modulation is anomalously reduced below an antiferromagnetic transition temperature TN in GdNiC2. In contrast, the q2 order vanishes below TN in TbNiC2. We demonstrate that R NiC2 (R = rare earth) compounds exhibit similarities with respect to their CDW phenomena, and discuss the effects of magnetic transitions on CDWs. We offer a possible displacement pattern of the modulated structure characterized by q1 C and q2 in terms of frustration.
Bats, J.W.; Feil, D.
1977-01-01
Electron density distributions, derived from ab initio molecular wavefunctions, have been calculated for CN− and SCN− ions. From these dynamic densities were calculated assuming rigid body thermal vibrations of the molecules. Comparison with the difference density in NaCN - 2H2O, NaSCN and NH4SCN, o
HI column density distribution function at z=0 : Connection to damped Ly alpha statistics
Zwaan, Martin; Verheijen, MAW; Briggs, FH
1999-01-01
We present a measurement of the HI column density distribution function f(N-HI) at the present epoch for column densities > 10(20) cm(-2). These high column densities compare to those measured in damped Ly alpha lines seen in absorption against background quasars. Although observationally rare, it a
Energy Technology Data Exchange (ETDEWEB)
Ma, Chun-Wang; Bai, Xiao-Man; Yu, Jiao; Wei, Hui-Ling [Henan Normal University, Institute of Particle and Nuclear Physics, Xinxiang (China)
2014-09-15
The isobaric yield ratio difference (IBD) between two reactions of similar experimental setups is found to be sensitive to nuclear density differences between projectiles. In this article, the IBD probe is used to study the density variation in neutron-rich {sup 48}Ca. By adjusting diffuseness in the neutron density distribution, three different neutron density distributions of {sup 48}Ca are obtained. The yields of fragments in the 80A MeV {sup 40,} {sup 48}Ca + {sup 12}C reactions are calculated by using a modified statistical abrasion-ablation model. It is found that the IBD results obtained from the prefragments are sensitive to the density distribution of the projectile, while the IBD results from the final fragments are less sensitive to the density distribution of the projectile. (orig.)
Specification of Density Functional Approximation by Radial Distribution Function of Bulk Fluid
Institute of Scientific and Technical Information of China (English)
ZHOUShi－Qi
2002-01-01
A systematic methodology is proposed to deal with the weighted density approximation version of classical density functional theory by employing the knowledge of radial distribution function of bulk fluid.The present methodology results from the concept of universality of the free energy density functional combined with the test particle method.It is shown that the new method is very accurate for the predictions of density distribution of a hard sphere fluid at different confining geometries.The physical foundation of the present methodology is also applied to the quantum density functional theory.
Charge density wave order in 1D mirror twin boundaries of single-layer MoSe2
Barja, Sara; Wickenburg, Sebastian; Liu, Zhen-Fei; Zhang, Yi; Ryu, Hyejin; Ugeda, Miguel M.; Hussain, Zahid; Shen, Zhi-Xun; Mo, Sung-Kwan; Wong, Ed; Salmeron, Miquel B.; Wang, Feng; Crommie, Michael F.; Ogletree, D. Frank; Neaton, Jeffrey B.; Weber-Bargioni, Alexander
2016-08-01
We provide direct evidence for the existence of isolated, one-dimensional charge density waves at mirror twin boundaries (MTBs) of single-layer semiconducting MoSe2. Such MTBs have been previously observed by transmission electron microscopy and have been predicted to be metallic in MoSe2 and MoS2. Our low-temperature scanning tunnelling microscopy/spectroscopy measurements revealed a substantial bandgap of 100 meV opening at the Fermi energy in the otherwise metallic one-dimensional structures. We found a periodic modulation in the density of states along the MTB, with a wavelength of approximately three lattice constants. In addition to mapping the energy-dependent density of states, we determined the atomic structure and bonding of the MTB through simultaneous high-resolution non-contact atomic force microscopy. Density functional theory calculations based on the observed structure reproduced both the gap opening and the spatially resolved density of states.
Estimation of current density distribution of PAFC by analysis of cell exhaust gas
Energy Technology Data Exchange (ETDEWEB)
Kato, S.; Seya, A. [Fuji Electric Co., Ltd., Ichihara-shi (Japan); Asano, A. [Fuji Electric Corporate, Ltd., Yokosuka-shi (Japan)
1996-12-31
To estimate distributions of Current densities, voltages, gas concentrations, etc., in phosphoric acid fuel cell (PAFC) stacks, is very important for getting fuel cells with higher quality. In this work, we leave developed a numerical simulation tool to map out the distribution in a PAFC stack. And especially to Study Current density distribution in the reaction area of the cell, we analyzed gas composition in several positions inside a gas outlet manifold of the PAFC stack. Comparing these measured data with calculated data, the current density distribution in a cell plane calculated by the simulation, was certified.
Indian Academy of Sciences (India)
Surajit Ghosh; K V S Girish; Subhadip Ghosh
2013-07-01
Intramolecular charge transfer of 4-,-dimethylamino cinnamaldehyde (DMACA) in vacuum and in five different aprotic solvents has been studied by using time-dependent density functional theory (TDDFT). Polarizable continuum model (PCM) was employed to consider solvent-solute interactions. The potential energy curves were constructed at different torsional angle of ,-dimethylamino moiety with respect to the adjacent phenyl ring. A large bathochromic shift in our calculated emission and absorption energies for polar solvents is a clear reminiscent of charge transfer nature of the excited state. Finally, the reported results are in agreement with experimental findings.
Form factors and transverse charge and magnetization densities in the hard-wall AdS/QCD model
Mondal, Chandan
2016-01-01
We present a study of the flavor form factors in the framework of a hard-wall AdS/QCD model and compare with the available experimental data. We obtain the flavor form factors by decomposing the Dirac and Pauli form factors for the nucleons using the charge and isospin symmetry. Further, we present a detailed study of the flavor structures of the charge and anomalous magnetization densities in the transverse plane. Both the unpolarized and the transversely polarized nucleons are considered here. We compare the AdS/QCD results with two standard phenomenological parametrizations.
Using ultrasound tomography to identify the distributions of density throughout the breast
Sak, Mark; Duric, Neb; Littrup, Peter; Sherman, Mark E.; Gierach, Gretchen L.
2016-04-01
Women with high breast density are at increased risk of developing breast cancer. Breast density has usually been defined using mammography as the ratio of fibroglandular tissue to total breast area. Ultrasound tomography (UST) is an emerging modality that can also be used to measure breast density. UST creates tomographic sound speed images of the patient's breast which is useful as sound speed is directly proportional to tissue density. Furthermore, the volumetric and quantitative information contained in the sound speed images can be used to describe the distribution of breast density. The work presented here measures the UST sound speed density distributions of 165 women with negative screening mammography. Frequency distributions of the sound speed voxel information were examined for each patient. In a preliminary analysis, the UST sound speed distributions were averaged across patients and grouped by various patient and density-related factors (e.g., age, body mass index, menopausal status, average mammographic breast density). It was found that differences in the distribution of density could be easily visualized for different patient groupings. Furthermore, findings suggest that the shape of the distributions may be used to identify participants with varying amounts of dense and non-dense tissue.
DEFF Research Database (Denmark)
De Vico, L.; Iversen, L.; Sørensen, Martin Hedegård;
2011-01-01
A single charge screening model of surface charge sensors in liquids (De Vico et al., Nanoscale, 2011, 3, 706-717) is extended to multiple charges to model the effect of the charge distributions of analyte proteins on FET sensor response. With this model we show that counter-intuitive signal...... changes (e.g. a positive signal change due to a net positive protein binding to a p-type conductor) can occur for certain combinations of charge distributions and Debye lengths. The new method is applied to interpret published experimental data on Streptavidin (Ishikawa et al., ACS Nano, 2009, 3, 3969...
DEFF Research Database (Denmark)
Sun, Bo; Dragicevic, Tomislav; Quintero, Juan Carlos Vasquez;
2015-01-01
Plug-in electrical vehicles will play a critical role in future smart grid and sudden connection of electrical vehicles chargers may cause huge power-peaks with high slew-rates on grid. In order to cope with this issue, this paper applies a distributed cooperative control for fast charging station...... with dedicated paralleled flywheel-based energy storage system. The distributed DC-bus signaling method is employed in the power coordination of grid and flywheel converters, and a distributed secondary controller generates DC voltage correction term to adjust the local voltage set-point through a dynamic...
A flexible distributed framework for realising electric and plug-in hybrid vehicle charging policies
Stüdli, S.; Crisostomi, E.; Middleton, R.; Shorten, R.
2012-08-01
Motivated by the problems of charging a number of electric vehicles via limited capacity infrastructure, this article considers the problem of individual load adjustment under a total capacity constraint. For reasons of scalability and simplified communications, distributed solutions to this problem are sought. Borrowing from communication networks (AIMD algorithms) and distributed convex optimisation, we describe a number of distributed algorithms for achieving relative average fairness whilst maximising utilisation. We present analysis and simulation results to show the performance of these algorithms. In the scenarios examined, the algorithm's performance is typically within 5% of that achievable in the ideal centralised case, but with greatly enhanced scalability and reduced communication requirements.
Fuks, J I
2013-01-01
We show that an asymmetric two-fermion two-site Hubbard model illustrates the essential features of long-range charge-transfer dynamics in a real-space molecule. We apply a resonant field that transfers one fermion from one site to the other. Via constrained search we find the exact ground-state exchange-correlation functional, and use it to propagate the Kohn-Sham system, giving the first "adiabatically-exact" calculation of time-resolved charge-transfer. This propagation fails to properly transfer charge. We analyze why by comparing the exact and adiabatically-exact potentials and discuss the role of the derivative discontinuity. The implication for real-space molecules is that even the best possible adiabatic approximation, despite capturing non-local step features relevant to dissociation and charge-transfer excitations, cannot capture fully time-resolved charge-transfer dynamics.
Energy Technology Data Exchange (ETDEWEB)
Airapetian, A. [Michigan Univ., Ann Arbor, MI (United States). Randall Lab. of Physics; Akopov, N.; Akopov, Z. [Yerevan Physics Institute (AR)] (and others)
2008-03-15
The momentum and helicity density distributions of the strange quark sea in the nucleon are obtained in leading order from charged-kaon production in deep-inelastic scattering on the deuteron. The distributions are extracted from spin-averaged K{sup {+-}} multiplicities, and from K{sup {+-}} and inclusive double-spin asymmetries for scattering of polarized positrons by a polarized deuterium target. The shape of the momentum distribution is softer than that of the average of the anti u and anti d quarks. (orig.)
Sadeghi, F.; Ansari, R.; Darvizeh, M.
2016-06-01
In this research, a continuum-based model is presented to explore potential energy, force distribution and oscillatory motion of ions, and in particular chloride ion, inside carbon nanotubes (CNTs) decorated by functional groups at two ends. To perform this, van der Waals (vdW) interactions between ion and nanotube are modeled by the 6-12 Lennard-Jones (LJ) potential, whereas the electrostatic interactions between ion and functional groups are modeled by the Coulomb potential and the total interactions are analytically derived by summing the vdW and electrostatic interactions. Making the assumption that carbon atoms and charge of functional groups are all uniformly distributed over the nanotube surface and the two ends of nanotube, respectively, a continuum approach is utilized to evaluate the related interactions. Based on the actual force distribution, the equation of motion is also solved numerically to arrive at the time history of displacement and velocity of inner core. With respect to the proposed formulations, comprehensive studies on the variations of potential energy and force distribution are carried out by varying functional group charge and nanotube length. Moreover, the effects of these parameters together with initial conditions on the oscillatory behavior of system are studied and discussed in detail. It is found out that chloride ion escapes more easily from negatively charged CNTs which is followed by uncharged and positively charged ones. It is further shown that the presence of functional groups leads to enhancing the operating frequency of such oscillatory systems especially when the electric charges of ion and functional groups have different signs.
Study of the height and density distributions of the 2-D granular system under vertical vibration
Pak, Hyuk Kyu; Kim, Kipom; Jun, Yonggun
1998-03-01
Melecular dynamic simulations and experiments are used to investigate the pattern formation of the granular materials in a vertically vibrated rigid container. The height and density distributions of the peak of the patterns in two dimensional system are measured using the simulation. The height distribution agrees with the experimental observation. At the peak of height of the pattern the density is observed minimum. From the information of the vertical velocities of the particles, the momentum flux distributions are studied also.
Hiemstra, T.; Riemsdijk, van W.H.; Rossberg, A.; Ulrich, K.
2009-01-01
The adsorption of uranyl (UO22+) on ferrihydrite has been evaluated with the charge distribution (CD) model for systems covering a very large range of conditions, i.e. pH, ionic strength, CO2 pressure, U(VI) concentration, and loading. Modeling suggests that uranyl forms bidentate inner sphere compl
Pearse, Alexander J; Gillette, Eleanor; Lee, Sang Bok; Rubloff, Gary W
2016-07-28
Morphologically complex electrochemical systems such as composite or nanostructured lithium ion battery electrodes exhibit spatially inhomogeneous internal current distributions, particularly when driven at high total currents, due to resistances in the electrodes and electrolyte, distributions of diffusion path lengths, and nonlinear current-voltage characteristics. Measuring and controlling these distributions is interesting from both an engineering standpoint, as nonhomogenous currents lead to lower utilization of electrode material, as well as from a fundamental standpoint, as comparisons between theory and experiment are relatively scarce. Here we describe a new approach using a deliberately simple model battery electrode to examine the current distribution in a electrode material limited by poor electronic conductivity. We utilize quantitative spatially resolved X-ray photoelectron spectroscopy to measure the spatial distribution of the state-of-charge of a V2O5 model electrode as a proxy measure for the current distribution on electrodes discharged at varying current densities. We show that the current at the electrode-electrolyte interface falls off with distance from the current collector, and that the current distribution is a strong function of total current. We compare the observed distributions with a simple analytical model which reproduces the dependence of the distribution on total current, but fails to predict the correct length scale. A more complete numerical simulation suggests that dynamic changes in the electronic conductivity of the V2O5 concurrent with lithium insertion may contribute to the differences between theory and experiment. Our observations should help inform design criteria for future electrode architectures. PMID:27357533
DEFF Research Database (Denmark)
Vitos, Levente; Kollár, J.; Skriver, Hans Lomholt
1997-01-01
We present a full charge-density technique to evaluate total energies from the output of self-consistent linear muffin-tin orbitals (LMTO) calculations in the atomic-sphere approximation (ASA). The Coulomb energy is calculated exactly from the complete, nonspherically symmetric charge density def...
Abramov, Y A; Volkov, A; Wu, G; Coppens, P
2000-11-01
A new module interfaced to the XD programming package has been used in the evaluation of intermolecular interactions and lattice energies of the crystals of p-nitroaniline, L-asparagine monohydrate and the pentapeptide Boc-Gln-D-Iva-Hyp-Ala-Phol (Boc = butoxycarbonyl, Iva = isovaline = ethylalanine, Phol = phenylalaninol). The electrostatic interactions are evaluated with the atom-centered distributed multipoles from KRMM (kappa'-restricted multipole model) refinements, using the Buckingham expression for non-overlapping charge densities. Results for p-nitroaniline are compared with Hartree-Fock (HF), density functional (DFT) and Moller-Plesset (MP2) supermolecular calculations and with HF and DFT periodic calculations. The HF and DFT methods fail to predict the stability of the p-nitroaniline crystal but the results of the experimental charge-density approach (ECDA) are in good agreement with both MP2 interaction energies and the experimental lattice energy. ECDA results for L-asparagine monohydrate compare well with those from DFT supermolecular and periodic HF calculations. The disorder of the terminal group in the pentapeptide, which persists at the experimental temperature of 20 K, corresponds to an energy difference of only 0.35 kJ mol(-1), which is too small to be reproduced with current methods. PMID:11058845
Charge states distribution of 3350 keV He ions channeled in silicon
Bentini, G G; Bianconi, M; Lotti, R; Lulli, G
2002-01-01
When an ion beam is aligned along a major crystalline axis the dominant interaction is with valence electrons. In this condition the charge exchange processes mostly concern the interaction between the incident ion and a quasi-free electron gas and a strong reduction of the charge-changing probabilities is expected. In this work, 3350 keV He sup + and He sup 2 sup + ions were aligned at small tilt angles about the axis of a 4650 A silicon crystalline membrane. The charge state distribution (CSD) of the transmitted ions was detected by an electro-magnetic analyzer having a very small acceptance angle. In these conditions the equilibration of the CSD was not yet reached and this allowed, making use of simple approximations, for the measurement of the valence electron loss cross-section.
Hovestadt, D.; Klecker, B.; Hoefner, H.; Scholer, M.; Gloeckler, G.; Ipavich, F. M.
1982-01-01
An analysis is presented of the ionic charge state distribution of He, C, O and Fe in the energetic storm particle event of September 28-29, 1978. Data were obtained with the ULEZEQ electrostatic analyzer-proportional counter on board the ISEE 3 spacecraft. The He(+)/He(++) ratio between 0.4 and 1 MeV/n is shown to be significantly lower during the energetic storm particle event than during the preceding period of solar flare particle enhancement, with a temporal evolution similar to that of the Fe/He ratio as reported by Klecker et al. (1981). Increases in the mean charge state for oxygen by about 3% and for iron by about 16% are also noted. The temporal variations in charge states are accounted for in terms of first-order Fermi acceleration of the pre-existing solar flare particles by a propagating interplanetary shock wave.
Song, Hongqiang; Chen, Yao; Zhang, Jie; Cheng, Xin; Zhao, Liang; Hu, Qiang; Li, Gang
2016-01-01
Magnetic clouds (MCs) are the interplanetary counterpart of coronal magnetic flux ropes. They can provide valuable information to reveal the flux rope characteristics at their eruption stage in the corona, which are unable to be explored in situ at present. In this paper, we make a comprehensive survey of the average iron charge state (Fe) distributions inside 96 MCs for solar cycle 23 using ACE (Advanced Composition Explorer) data. As the Fe in the solar wind are typically around 9+ to 11+, the Fe charge state is defined as high when the Fe is larger than 12+, which implies the existence of a considerable amount of Fe ions with high charge states (e.g., \\geq 16+). The statistical results show that the Fe distributions of 92 (~ 96%) MCs can be classified into four groups with different characteristics. In group A (11 MCs), the Fe shows a bimodal distribution with both peaks higher than 12+. Group B (4 MCs) presents a unimodal distribution of Fe with its peak higher than 12+. In groups C (29 MCs) and D (48 MCs...
Analysis on insulator–metal transition in yttrium doped LSMO from electron density distribution
Indian Academy of Sciences (India)
S Israel; S Saravana Kumar; R Renuretson; R A J R Sheeba; R Saravanan
2012-02-01
Yttrium doped LSMO (La1−SrMnO3) was prepared using sol–gel technique and analysed for the insulator–metal transition fromcharge density variation in the unit cell with respect to different stoichiometric inclusion of yttrium. X-ray powder diffraction profiles of the samples were obtained and the well known Rietveld method and a versatile tool called maximum entropy method (MEM) were used for structural and profile refinement. The charge density in the unit cell was constructed using refined structure factors and was analysed. The charge ordering taking place in the insulator–metal transition was investigated and quantified. The insulator–metal transition was found to occur when 20% of La/Sr atoms were replaced by yttrium. The changes in the charge environment have also been analysed.
Öhrn, Anders; Hermida-Ramon, Jose M; Karlström, Gunnar
2016-05-10
The effects of charge overlap, or charge penetration, are neglected in most force fields and interaction terms in QM/MM methods. The effects are however significant at intermolecular distances near the van der Waals minimum. In the present study, we propose a method to evaluate the intermolecular Coloumb interaction using Slater-type functions, thus explicitly modeling the charge overlap. The computational cost of the method is low, which allows it to be used in large systems with most force fields as well as in QM/MM schemes. The charge distribution is modeled as a distributed multipole expansion up to quadrupole and Slater-type functions of angular momentum up to L = 1. The exponents of the Slater-type functions are obtained using a divide-and-conquer method to avoid the curse of dimensionality that otherwise is present for large nonlinear optimizations. A Levenberg-Marquardt algorithm is applied in the fitting process. A set of parameters is obtained for each molecule, and the process is fully automated. Calculations have been performed in the carbon monoxide and the water dimers to illustrate the model. Results show a very good accuracy of the model with relative errors in the electrostatic potential lower than 3% over all reasonable separations. At very short distances where the charge overlaps is the most significant, errors are lower than 8% and lower than 3.5% at distances near the van der Waals minimum. PMID:27015000
Inversion of the Abel equation for toroidal density distributions
Ciotti, L
1999-01-01
In this paper I present three new results of astronomical interest concerning the theory of Abel inversion. 1) I show that in the case of a spatial emissivity that is constant on toroidal surfaces and projected along the symmetry axis perpendicular to the torus' equatorial plane, it is possible to invert the projection integral. From the surface (i.e. projected) brightness profile one then formally recovers the original spatial distribution as a function of the toroidal radius. 2) By applying the above-described inversion formula, I show that if the projected profile is described by a truncated off-center gaussian, the functional form of the related spatial emissivity is very simple and - most important - nowhere negative for any value of the gaussian parameters, a property which is not guaranteed - in general - by Abel inversion. 3) Finally, I show how a generic multimodal centrally symmetric brightness distribution can be deprojected using a sum of truncated off-center gaussians, recovering the spatial emis...
Spin polarization driven by a charge-density wave in monolayer 1T−TaS2
Zhang, Qingyun
2014-08-06
Using first-principles calculations, we investigate the electronic and vibrational properties of monolayer T-phase TaS2. We demonstrate that a charge-density wave is energetically favorable at low temperature, similar to bulk 1T-TaS2. Electron-phonon coupling is found to be essential for the lattice reconstruction. The charge-density wave results in a strong localization of the electronic states near the Fermi level and consequently in spin polarization, transforming the material into a magnetic semiconductor with enhanced electronic correlations. The combination of inherent spin polarization with a semiconducting nature distinguishes the monolayer fundamentally from the bulk compound as well as from other two-dimensional transition metal dichalcogenides. Monolayer T-phase TaS2 therefore has the potential to enable two-dimensional spintronics. © 2014 American Physical Society.
Indian Academy of Sciences (India)
Reji Thomas; Shrinwantu Pal; Ayan Datta; Mariusz K Marchewka; Henryk Ratajczak; Swapan K Pati; G U Kulkarni
2008-11-01
An experimental charge density study has been carried out on proton-transfer complexes exhibiting nonlinear optical (NLO) properties-melaminium tartrate monohydrate and L-asparaginium picrate employing high-resolution X-ray diffraction at 100 K. Both the complexes crystallize in non-centric space group P21 and the structures exhibit interesting patterns of N-H…O and O-H…O hydrogen bonding. Experimental determination of the dipole moment () for the asymmetric unit reveals that for both the crystals, there is a large cooperative enhancement in the crystalline arising essentially due to hydrogen bond mediated charge transfer between the melaminium ion and the L-tartrate in one case, between the Lasparaginium ion and the picrate in the other complex. We have additionally performed theoretical calculations at the density functional theory (DFT) level to understand the origin of enhancement of the dipole moments in the two systems.
Arguello, C J; Rosenthal, E P; Andrade, E F; Jin, W; Yeh, P C; Zaki, N; Jia, S; Cava, R J; Fernandes, R M; Millis, A J; Valla, T; Osgood, R M; Pasupathy, A N
2015-01-23
We show that a small number of intentionally introduced defects can be used as a spectroscopic tool to amplify quasiparticle interference in 2H-NbSe2 that we measure by scanning tunneling spectroscopic imaging. We show, from the momentum and energy dependence of the quasiparticle interference, that Fermi surface nesting is inconsequential to charge density wave formation in 2H-NbSe2. We demonstrate that, by combining quasiparticle interference data with additional knowledge of the quasiparticle band structure from angle resolved photoemission measurements, one can extract the wave vector and energy dependence of the important electronic scattering processes thereby obtaining direct information both about the fermiology and the interactions. In 2H-NbSe2, we use this combination to confirm that the important near-Fermi-surface electronic physics is dominated by the coupling of the quasiparticles to soft mode phonons at a wave vector different from the charge density wave ordering wave vector.
Xie, Wei; Liu, Feilong; Shi, Sha; Ruden, P Paul; Frisbie, C Daniel
2014-04-23
A transport model based on hole-density-dependent trapping is proposed to explain the two unusual conductivity peaks at surface hole densities above 10(13) cm(-2) in rubrene electric double layer transistors (EDLTs). Hole transport in rubrene is described to occur via multiple percolation pathways, where conduction is dominated by transport in the free-site channel at low hole density, and in the trap-site channel at larger hole density. PMID:24496822
Tran, Clara T H; Kondyurin, Alexey; Chrzanowski, Wojciech; Bilek, Marcela M M; McKenzie, David R
2014-10-01
Plasma immersion ion implantation (PIII) treatment of polymers creates a biointerface capable of direct covalent immobilization of biomolecules. The immobilization of protein molecules is achieved by covalent bonds formed between embedded radicals on the treated surface and amino acid side chains and cells can be immobilized through cell-wall proteins. The attachment density of negatively charged entities on a PIII treated surface is inhibited by its negative surface charge at neutral pH. To reduce the negative charge of PIII treated surfaces in phosphate buffer (pH 7.4, 11mM), we develop an effective approach of grafting allylamine monomers onto the treated surface. The results reveal reactions between allylamine and radicals on the PIII treated surface. One of these triggers polymerization, increasing the number of amine groups grafted. As a consequence, the PIII treated polystyrene surface after allylamine exposure becomes more hydrophobic and less negatively charged in phosphate buffer. Using yeast cells as an example, we have shown a significant improvement (6-15 times) of cell density immobilized on the PIII treated surface after exposure to allylamine. PMID:25092587
Evaluation of mobile dislocation density based on distribution function of dislocation segments
Institute of Scientific and Technical Information of China (English)
周志敏; 孙艳蕊; 周海涛
2004-01-01
A function is offered to represent the distribution of reduced length of dislocation segments. The segment distribution of materials, e. g. , MgO and Cu, can be well described by taking appropriate values of parametersm and n. Based on this function, a model for evaluating the mobile dislocation density is developed. Provided the total dislocation density and applied stress are known, the mobile dislocation density could be readily assessed by using this model. For pure copper the mobile dislocation density and strain rates at deferent strains are evaluated. The calculated results are consistent with the known experimental data.
Specification of Density Functional Approximation by Radial Distribution Function of Bulk Fluid
Institute of Scientific and Technical Information of China (English)
ZHOU Shi-Qi
2002-01-01
A systematic methodology is proposed to deal with the weighted density approximation version of clas-sical density functional theory by employing the knowledge of radial distribution function of bulk fluid. The presentmethodology results from the concept of universality of the free energy density functional combined with the test particlemethod. It is shown that the new method is very accurate for the predictions of density distribution ofa hard sphere fluidat different confining geometries. The physical foundation of the present methodology is also applied to the quantumdensity functional theory.
Unconventional charge density wave in the organic conductor alpha-(BEDT-TTF)_2KHg(SCN)_4
Maki, Kazumi; Dóra, Balázs; Kartsovnik, Mark; Virosztek, Attila; Korin-Hamzic, Bojana; Basletic, Mario
2002-01-01
The low temperature phase (LTP) of alpha-(BEDT-TTF)_2KHg(SCN)_4 salt is known for its surprising angular dependent magnetoresistance (ADMR), which has been studied intensively in the last decade. However, the nature of the LTP has not been understood until now. Here we analyse theoretically ADMR in unconventional (or nodal) charge density wave (UCDW). In magnetic field the quasiparticle spectrum in UCDW is quantized, which gives rise to spectacular ADMR. The present model accounts for many st...
Ha, Bae-Yeun
2000-01-01
Counterion-mediated attractions between like-charged fluid membranes are long-ranged and non-pairwise additive at high temperatures. At zero temperature, however, they are pairwise additive and decay exponentially with the membrane separation. Here we show that the nature of these attractions is determined by the dominant modes of fluctuations in the density of counterions. While the non-pairwise additive interactions arise from long-wavelength fluctuations and vanish at zero temperature, the...
Wen, Rui-Tao; Granqvist, Claes G.; Niklasson, Gunnar A.
2014-01-01
Ni-oxide-based thin films were produced by reactive direct-current magnetron sputtering and were characterized by X-ray diffraction and Rutherford backscattering spectroscopy. Intercalation of Li+ ions was accomplished by cyclic voltammetry (CV) in an electrolyte of LiClO4 in propylene carbonate, and electrochromism was documented by spectrophotometry. The charge density exchange, and hence the optical modulation span, decayed gradually upon repeated cycling. This phenomenon was accurately de...
Institute of Scientific and Technical Information of China (English)
杨忠志; 沈尔忠
1996-01-01
On the basis of a more precise expression of the atomic effective electronegativity deduced from the density functional theory and electronegativity equalization principle, a new scheme for calculating the group electronegativity and the atomic charges in a group is proposed and programed, and various parameters of electronegativity and hardness are given for some common atoms. Through calculation, analysis and comparison of more than one hundred groups, it is shown that the results from this scheme are reasonable and may be extended.
Energy Technology Data Exchange (ETDEWEB)
Yigit, Cemil; Dzubiella, Joachim, E-mail: joachim.dzubiella@helmholtz-berlin.de [Soft Matter and Functional Materials, Helmholtz-Zentrum Berlin, 14109 Berlin (Germany); Helmholtz Virtual Institute “Multifunctional Biomaterials for Medicine,” 14513 Teltow (Germany); Institut für Physik, Humboldt-Universität zu Berlin, 12489 Berlin (Germany); Heyda, Jan [Department of Physical Chemistry, University of Chemistry and Technology, Prague, 166 28 Praha 6 (Czech Republic)
2015-08-14
We introduce a set of charged patchy particle models (CPPMs) in order to systematically study the influence of electrostatic charge patchiness and multipolarity on macromolecular interactions by means of implicit-solvent, explicit-ion Langevin dynamics simulations employing the Gromacs software. We consider well-defined zero-, one-, and two-patched spherical globules each of the same net charge and (nanometer) size which are composed of discrete atoms. The studied mono- and multipole moments of the CPPMs are comparable to those of globular proteins with similar size. We first characterize ion distributions and electrostatic potentials around a single CPPM. Although angle-resolved radial distribution functions reveal the expected local accumulation and depletion of counter- and co-ions around the patches, respectively, the orientation-averaged electrostatic potential shows only a small variation among the various CPPMs due to space charge cancellations. Furthermore, we study the orientation-averaged potential of mean force (PMF), the number of accumulated ions on the patches, as well as the CPPM orientations along the center-to-center distance of a pair of CPPMs. We compare the PMFs to the classical Derjaguin-Verwey-Landau-Overbeek theory and previously introduced orientation-averaged Debye-Hückel pair potentials including dipolar interactions. Our simulations confirm the adequacy of the theories in their respective regimes of validity, while low salt concentrations and large multipolar interactions remain a challenge for tractable theoretical descriptions.
Zhang, Xiaoqing; Sessler, Gerhard M.; Xue, Yuan; Ma, Xingchen
2016-05-01
Laminated fluoropolymer films with a regular microstructure were made from compact fluoroethylenepropylene (FEP) and porous polytetrafluoroethylene (PTFE) using a process consisting of patterning and fusion bonding steps. The fabricated films were rendered piezoelectric via the contact charging or corona charging methods. The piezoelectric responses of such piezoelectret films were measured in the frequency range 100 Hz–100 kHz. The results show that the acoustic impedance of the FEP/PTFE films is around 0.014–0.030 MRayl. Dynamic piezoelectric d 33 coefficients of up to 500 pC N‑1 were achieved at 100 Hz for these films. Microphones built with such films exhibit flat response curves in a broad frequency range if the diffraction effects are eliminated. Bonded films with all positive charges deposited in the porous PTFE layers show the best thermal stability: after annealing for 1100 min at 125 °C, the remaining d 33 at 1020 Hz is about 30% of the initial value, corresponding to 105 pC N‑1, and it remains relatively stable at this temperature. This remarkable thermal stability has to be attributed to the fact that positive charges are more permanent in porous PTFE than in FEP. The entire charge distribution exhibits much better thermal stability than is achievable for customary polypropylene piezoelectrets.
Schreiber, Michael; Siewert, Jens; Vojta, Thomas
2001-08-01
We investigate the properties of interacting electrons in a parabolic confinement. To this end we numerically diagonalize the Hamiltonian using the Hartree-Fock based diagonalization method which is related to the configuration interaction approach. We study different types of interactions, Coulomb as well as short range. In addition to the ground state energy we calculate the spatial charge distribution and compare the results to those of the classical calculation. We find that a sufficiently strong screened Coulomb interaction produces energy level bunching for classical as well as for quantum-mechanical dots. Bunching in the quantum-mechanical system occurs due to an interplay of kinetic and interaction energy, moreover, it is observed well before reaching the limit of a Wigner crystal. It also turns out that the shell structure of classical and quantum mechanical spatial charge distributions is quite similar.
Institute of Scientific and Technical Information of China (English)
WANG Wei-Hua; ZOU Liang-Jian
2006-01-01
The electronic and magnetic properties as well as the spatial charge distribution of single Mn impurity in Ⅲ-V diluted magnetic semiconductors are obtained when the degeneracy of the p orbits contributed from the four nearest-neighbouring As(N) atoms is taken into account. We show that in the ground state, the Mn spin is strongly antiferromagnetically coupled to the surrounding As(N) atoms when the p - d hybridization Vpd is large and both the hole level Ev and the impurity level Ed are close to the Fermi energy. The spatial charge distribution of the Mn acceptor in the (110) plane is non-spherically symmetric, in good agreement with the recent STM images.
Charge state distribution of light ions at glancing collision with solid surface
International Nuclear Information System (INIS)
Many experimental results have suggested that the charge state distribution of ions have penetrated through solid is different from that inside the solid. It is important to clarify the physical process taking place at solid surface in order to know the states of ions inside the solid from those observed outside the solid. In the present paper, we report our measurement of charge state distributions of He+ and H2+ ions having been scattered in small angles (less than 40) at surfaces of Au, Ag and C. One of the advantages of the use of the glancing collision of ions at solid surface for the study of ion-surface interaction is that the dwell time of ion near solid surface can be made more than 100 times longer than that in normal transmission experiments. The longer dwell times may alter any contribution of solid surface to electron capture and loss of ions
Adam, Jaroslav; Aggarwal, Madan Mohan; Aglieri Rinella, Gianluca; Agnello, Michelangelo; Agrawal, Neelima; Ahammed, Zubayer; Ahn, Sang Un; Aiola, Salvatore; Akindinov, Alexander; Alam, Sk Noor; Aleksandrov, Dmitry; Alessandro, Bruno; Alexandre, Didier; Alfaro Molina, Jose Ruben; Alici, Andrea; Alkin, Anton; Millan Almaraz, Jesus Roberto; Alme, Johan; Alt, Torsten; Altinpinar, Sedat; Altsybeev, Igor; Alves Garcia Prado, Caio; Andrei, Cristian; Andronic, Anton; Anguelov, Venelin; Anielski, Jonas; Anticic, Tome; Antinori, Federico; Antonioli, Pietro; Aphecetche, Laurent Bernard; Appelshaeuser, Harald; Arcelli, Silvia; Arnaldi, Roberta; Arnold, Oliver Werner; Arsene, Ionut Cristian; Arslandok, Mesut; Audurier, Benjamin; Augustinus, Andre; Averbeck, Ralf Peter; Azmi, Mohd Danish; Badala, Angela; Baek, Yong Wook; Bagnasco, Stefano; Bailhache, Raphaelle Marie; Bala, Renu; Balasubramanian, Supraja; Baldisseri, Alberto; Baral, Rama Chandra; Barbano, Anastasia Maria; Barbera, Roberto; Barile, Francesco; Barnafoldi, Gergely Gabor; Barnby, Lee Stuart; Ramillien Barret, Valerie; Bartalini, Paolo; Barth, Klaus; Bartke, Jerzy Gustaw; Bartsch, Esther; Basile, Maurizio; Bastid, Nicole; Basu, Sumit; Bathen, Bastian; Batigne, Guillaume; Batista Camejo, Arianna; Batyunya, Boris; Batzing, Paul Christoph; Bearden, Ian Gardner; Beck, Hans; Bedda, Cristina; Behera, Nirbhay Kumar; Belikov, Iouri; Bellini, Francesca; Bello Martinez, Hector; Bellwied, Rene; Belmont Iii, Ronald John; Belmont Moreno, Ernesto; Belyaev, Vladimir; Bencedi, Gyula; Beole, Stefania; Berceanu, Ionela; Bercuci, Alexandru; Berdnikov, Yaroslav; Berenyi, Daniel; Bertens, Redmer Alexander; Berzano, Dario; Betev, Latchezar; Bhasin, Anju; Bhat, Inayat Rasool; Bhati, Ashok Kumar; Bhattacharjee, Buddhadeb; Bhom, Jihyun; Bianchi, Livio; Bianchi, Nicola; Bianchin, Chiara; Bielcik, Jaroslav; Bielcikova, Jana; Bilandzic, Ante; Biswas, Rathijit; Biswas, Saikat; Bjelogrlic, Sandro; Blair, Justin Thomas; Blau, Dmitry; Blume, Christoph; Bock, Friederike; 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Riabov, Viktor; Ricci, Renato Angelo; Richert, Tuva Ora Herenui; Richter, Matthias Rudolph; Riedler, Petra; Riegler, Werner; Riggi, Francesco; Ristea, Catalin-Lucian; Rocco, Elena; Rodriguez Cahuantzi, Mario; Rodriguez Manso, Alis; Roeed, Ketil; Rogochaya, Elena; Rohr, David Michael; Roehrich, Dieter; Romita, Rosa; Ronchetti, Federico; Ronflette, Lucile; Rosnet, Philippe; Rossi, Andrea; Roukoutakis, Filimon; Roy, Ankhi; Roy, Christelle Sophie; Roy, Pradip Kumar; Rubio Montero, Antonio Juan; Rui, Rinaldo; Russo, Riccardo; Ryabinkin, Evgeny; Ryabov, Yury; Rybicki, Andrzej; Sadovskiy, Sergey; Safarik, Karel; Sahlmuller, Baldo; Sahoo, Pragati; Sahoo, Raghunath; Sahoo, Sarita; Sahu, Pradip Kumar; Saini, Jogender; Sakai, Shingo; Saleh, Mohammad Ahmad; Salzwedel, Jai Samuel Nielsen; Sambyal, Sanjeev Singh; Samsonov, Vladimir; Sandor, Ladislav; Sandoval, Andres; Sano, Masato; Sarkar, Debojit; Scapparone, Eugenio; Scarlassara, Fernando; Schiaua, Claudiu Cornel; Schicker, Rainer Martin; Schmidt, Christian Joachim; 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Zhalov, Mikhail; Zhang, Haitao; Zhang, Xiaoming; Zhang, Yonghong; Chunhui, Zhang; Zhang, Zuman; Zhao, Chengxin; Zhigareva, Natalia; Zhou, Daicui; Zhou, You; Zhou, Zhuo; Zhu, Hongsheng; Zhu, Jianhui; Zichichi, Antonino; Zimmermann, Alice; Zimmermann, Markus Bernhard; Zinovjev, Gennady; Zyzak, Maksym
2016-01-01
The pseudorapidity ($\\eta$) and transverse-momentum ($p_{\\rm T}$) distributions of charged particles produced in proton-proton collisions are measured at the centre-of-mass energy $\\sqrt{s}$ = 13 TeV. The pseudorapidity distribution in $|\\eta|<$ 1.8 is reported for inelastic events and for events with at least one charged particle in $|\\eta|<$ 1. The pseudorapidity density of charged particles produced in the pseudorapidity region $|\\eta|<$ 0.5 is 5.31 $\\pm$ 0.18 and 6.46 $\\pm$ 0.19 for the two event classes, respectively. The transverse-momentum distribution of charged particles is measured in the range 0.15 $<$ $p_{\\rm T}$ $<$ 20 GeV/c and $|\\eta|<$ 0.8 for events with at least one charged particle in $|\\eta|<$ 1. The correlation between transverse momentum and particle multiplicity is also investigated by studying the evolution of the spectra with event multiplicity. The results are compared with calculations from PYTHIA and EPOS Monte Carlo generators.
Kayitmazer, A B; Koksal, A F; Kilic Iyilik, E
2015-11-28
Hyaluronic acid (HA) and chitosan (CH) can form nanoparticles, hydrogels, microspheres, sponges, and films, all with a wide range of biomedical applications. This variety of phases reflects the multiple pathways available to HA/CH complexes. Here, we use turbidimetry, dynamic light scattering, light microscopy and zeta potential measurements to show that the state of the dense phase depends on the molar ratio of HA carboxyl to CH amines, and is strongly dependent on their respective degrees of ionization, α and β. Due to the strong charge complementarity between HA and CH, electrostatic self-assembly takes place at very acidic pH, but is almost unobservable at ionic strength (I) ≥ 1.5 M NaCl. All systems display discontinuity in the I-dependence of the turbidity, corresponding to a transition from coacervates to flocculates. An increase in either polymer chain length or charge density enhances phase separation. Remarkably, non-stoichiometric coacervate suspensions form at zeta potentials far away from zero. This result is attributed to the entropic effects of chain semi-flexibility as well as to the charge mismatch between the two biopolymers. PMID:26406548
Charged-particle pseudorapidity distributions in Au+Au collisions at RHIC
Institute of Scientific and Technical Information of China (English)
WANG Zeng-Wei; JIANG Zhi-Jin
2009-01-01
Using the Glauber model, we present the formulas for calculating the numbers of participants,spectators and binary nucleon-nucleon collisions. Based on this work, we get the pseudorapidity distributions of charged particles as the function of the impact parameter in nucleus-nucleus collisions. The theoretical results agree well with the experimental observations made by the BRAHMS Collaboration in Au+Au collisions at √SNN=200 GeV in different centrality bins over the whole pseudorapidity range.
Gluon saturation and pseudo-rapidity distributions of charged hadrons at RHIC energy regions
Institute of Scientific and Technical Information of China (English)
WEI Xin-Bing; FENG Sheng-Qin
2012-01-01
We modified the gluon saturation model by rescaling the momentum fraction according to saturation momentum and introduced Cooper-Frye hydrodynamic evolution to systematically study the pseudorapidity distributions of final charged hadrons at different energies and different centralities for Au-Au collisions in relativistic heavy-ion collisions at the BNL Relativistic Heavy Ion Collider (RHIC).The features of both gluon saturation and hydrodynamic evolution at different energies and different centralities for Au-Au collisions are investigated in this paper.
Pearson, Lee H.; Dennison, JR; Griffiths, Erick W.; Pearson, A. C.
2016-01-01
This paper discusses an effort to develop advanced pulsed electroacoustic (PEA) measurement system capabilities that incorporate state-of-the-art hardware and improved signal processing and modeling to characterize embedded charge distributions in thin dielectric films. Objectives in developing this system include: (1) improved spatial resolution, while maintaining reasonable temporal resolution; (2) improved signal processing tools for increased signal/noise ratios; (3) integrated PEA modeli...
Seung Yol Jeong; Sooyeon Jeong; Sang Won Lee; Sung Tae Kim; Daeho Kim; Hee Jin Jeong; Joong Tark Han; Kang-Jun Baeg; Sunhye Yang; Mun Seok Jeong; Geon-Woong Lee
2015-01-01
We introduce a high-performance molecular sensor using self-corrugated chemically modified graphene as a three dimensional (3D) structure that indicates anisotropic charge distribution. This is capable of room-temperature operation, and, in particular, exhibiting high sensitivity and reversible fast response with equilibrium region. The morphology consists of periodic, “cratered” arrays that can be formed by condensation and evaporation of graphene oxide (GO) solution on interdigitated electr...
Smolyar, V A; Eremin, V V
2002-01-01
In terms of a kinetic equation diffusion model for a beam of electrons falling on a target along the normal one derived analytical formulae for distributions of separated energy and injected charge. In this case, no empirical adjustable parameters are introduced to the theory. The calculated distributions of separated energy for an electron plate directed source within infinite medium for C, Al, Sn and Pb are in good consistency with the Spencer data derived on the basis of the accurate solution of the Bethe equation being the source one in assumption of a diffusion model, as well
Flywheel-Based Distributed Bus Signalling Strategy for the Public Fast Charging Station
DEFF Research Database (Denmark)
Dragicevic, Tomislav; Sucic, Stepjan; Vasquez, Juan Carlos;
2014-01-01
Fast charging stations (FCS) are able to recharge plug-in hybrid electric vehicles (pHEVs) in less than half an hour, thus representing an appealing concept to vehicle owners since the off-road time is similar as for refuelling at conventional public gas stations. However, since these FCS plugs...... (ESS) which is able to mitigate those impacts by ramping the initial power peak. The balancing strategy was implemented in a distributed manner to grid and flywheel interfacing converters by means of distributed bus signaling (DBS) method. Since the parameters in the proposed upper hierarchical control...
Unfolding of event-by-event net-charge distributions in heavy-ion collisions
Garg, P; Netrakanti, P K; Mohanty, A K; Mohanty, B
2013-01-01
An unfolding method, based on Bayes theorem is presented to obtain true event-by-event net-charge multiplicity distribution from a corresponding measured distribution, which is subjected to detector artifacts. The unfolding is demonstrated to work for widely varying particle production mechanism, beam energy and collision centrality. Further the necessity of taking into account the detector effects is emphasized before comparing the experimental measurements to the theoretical calculations, particularly in case of higher moments. The advantage of this approach being that one need not construct new observable to cancel out detector effects which loose their ability to be connected to physical quantities calculable in standard theories.
Coordinated Charging of Electric Vehicles for Congestion Prevention in the Distribution Grid
DEFF Research Database (Denmark)
Hu, Junjie; You, Shi; Lind, Morten;
2014-01-01
Distributed energy resources (DERs), like electric vehicles (EVs), can offer valuable services to power systems, such as enabling renewable energy to the electricity producer and providing ancillary services to the system operator. However, these new DERs may challenge the distribution grid due...... to insufficient capacity in peak hours. This paper aims to coordinate the valuable services and operation constraints of three actors: the EV owner, the Fleet operator (FO) and the Distribution system operator (DSO), considering the individual EV owner’s driving requirement, the charging cost of EV and thermal...... for their vehicles with lower cost. The congestion problem will be solved by a coordination between DSO and FOs through a distribution grid capacity market scheme. Then, a mathematical formulation of the market scheme is presented. Further, some case studies are shown to illustrate the effectiveness of the proposed...
Double density dynamics: realizing a joint distribution of a physical system and a parameter system
International Nuclear Information System (INIS)
To perform a variety of types of molecular dynamics simulations, we created a deterministic method termed ‘double density dynamics’ (DDD), which realizes an arbitrary distribution for both physical variables and their associated parameters simultaneously. Specifically, we constructed an ordinary differential equation that has an invariant density relating to a joint distribution of the physical system and the parameter system. A generalized density function leads to a physical system that develops under nonequilibrium environment-describing superstatistics. The joint distribution density of the physical system and the parameter system appears as the Radon–Nikodym derivative of a distribution that is created by a scaled long-time average, generated from the flow of the differential equation under an ergodic assumption. The general mathematical framework is fully discussed to address the theoretical possibility of our method, and a numerical example representing a 1D harmonic oscillator is provided to validate the method being applied to the temperature parameters. (paper)
Solar flux density distribution using a separation of variables/superposition technique
Energy Technology Data Exchange (ETDEWEB)
Elsayed, M.M.; Fathalah, K.A. (King Abdulaziz Univ., Jeddah (Saudi Arabia). Dept. of Thermal Engineering)
1994-01-01
A separation of variables/superposition technique is used to determine the flux density distribution [Gamma] on the receiver plane of a central receiver system. This distribution is determined in terms of the flux density distribution F on the image plane. The distribution F is found in terms of the algebraic sum of several flux distribution functions. Each of these functions F[sub i] is determined in terms of a basic demensionless flux density function [phi], transferred to have its origin of coordinates at one corner of the principal image of the heliostat. Using a special coordinate system, [phi] is found to depend only on the angle [theta][sup *] between the sides of the principal image of the heliostat, for a given Sun shape and error function. Calculations of [theta][sup *] and the lengths of the sides of the principal image are performed for a wide range of parameters, which include solar zenith and azimuth angles, radial distance of heliostat and its position azimuth angle, tower height, concentration and dimensions of the heliostat. For a given effective Sun shape, the basic dimensionless flux density distribution [phi] is calculated for several values of [theta][sup *]. This distribution is stored in a computer and used in an illustrative example to determine the flux density distribution on a receiver plane. (author)
Landau Level Splittings, Phase Transitions, and Nonuniform Charge Distribution in Trilayer Graphene.
Campos, Leonardo C; Taychatanapat, Thiti; Serbyn, Maksym; Surakitbovorn, Kawin; Watanabe, Kenji; Taniguchi, Takashi; Abanin, Dmitry A; Jarillo-Herrero, Pablo
2016-08-01
We report on magnetotransport studies of dual-gated, Bernal-stacked trilayer graphene (TLG) encapsulated in boron nitride crystals. We observe a quantum Hall effect staircase which indicates a complete lifting of the 12-fold degeneracy of the zeroth Landau level. As a function of perpendicular electric field, our data exhibit a sequence of phase transitions between all integer quantum Hall states in the filling factor interval -8Landau level splittings and quantum Hall phase transitions can be understood within a single-particle picture, but imply the presence of a charge density imbalance between the inner and outer layers of TLG, even at charge neutrality and zero transverse electric field. Our results indicate the importance of a previously unaccounted band structure parameter which, together with a more accurate estimate of the other tight-binding parameters, results in a significantly improved determination of the electronic and Landau level structure of TLG.
Landau Level Splittings, Phase Transitions, and Nonuniform Charge Distribution in Trilayer Graphene
Campos, Leonardo C.; Taychatanapat, Thiti; Serbyn, Maksym; Surakitbovorn, Kawin; Watanabe, Kenji; Taniguchi, Takashi; Abanin, Dmitry A.; Jarillo-Herrero, Pablo
2016-08-01
We report on magnetotransport studies of dual-gated, Bernal-stacked trilayer graphene (TLG) encapsulated in boron nitride crystals. We observe a quantum Hall effect staircase which indicates a complete lifting of the 12-fold degeneracy of the zeroth Landau level. As a function of perpendicular electric field, our data exhibit a sequence of phase transitions between all integer quantum Hall states in the filling factor interval -8 graphene, the observed Landau level splittings and quantum Hall phase transitions can be understood within a single-particle picture, but imply the presence of a charge density imbalance between the inner and outer layers of TLG, even at charge neutrality and zero transverse electric field. Our results indicate the importance of a previously unaccounted band structure parameter which, together with a more accurate estimate of the other tight-binding parameters, results in a significantly improved determination of the electronic and Landau level structure of TLG.
Angenendt, Knut; Johansson, Patrik
2011-06-23
The solvation of lithium salts in ionic liquids (ILs) leads to the creation of a lithium ion carrying species quite different from those found in traditional nonaqueous lithium battery electrolytes. The most striking differences are that these species are composed only of ions and in general negatively charged. In many IL-based electrolytes, the dominant species are triplets, and the charge, stability, and size of the triplets have a large impact on the total ion conductivity, the lithium ion mobility, and also the lithium ion delivery at the electrode. As an inherent advantage, the triplets can be altered by selecting lithium salts and ionic liquids with different anions. Thus, within certain limits, the lithium ion carrying species can even be tailored toward distinct important properties for battery application. Here, we show by DFT calculations that the resulting charge carrying species from combinations of ionic liquids and lithium salts and also some resulting electrolyte properties can be predicted. PMID:21591707
Indian Academy of Sciences (India)
Dhamodaran Arunbabu; Mousumi Hazarika; Somsankar Naik; Tushar Jana
2009-12-01
We have synthesized highly charged, crosslinked poly (styrene--divinylbenzene--sulfopropyl methacrylate) copolymer colloidal particles using emulsion polymerization. The effects of concentration of the emulsifier and the initiator on the particle size and the charge density of the colloidal particles are studied. Colloidal particle size is highly dependent upon the concentration of the emulsifier and the initiator. The colloidal particle diameter decreases with increasing concentration of the emulsifier and increases with increasing concentration of the initiator in the polymerization mixture. Number of particles, surface charge density and charges per particle are also functions of both the emulsifier and the initiator concentration. The surface charge density and the number of charges per sphere increase with increasing particle diameter. These copolymer colloid particles self assemble readily and diffract visible light. Polymer hydrogel imbibed with these colloids shows the light diffraction.
Modeling on oxide dependent 2DEG sheet charge density and threshold voltage in AlGaN/GaN MOSHEMT
Panda, J.; Jena, K.; Swain, R.; Lenka, T. R.
2016-04-01
We have developed a physics based analytical model for the calculation of threshold voltage, two dimensional electron gas (2DEG) density and surface potential for AlGaN/GaN metal oxide semiconductor high electron mobility transistors (MOSHEMT). The developed model includes important parameters like polarization charge density at oxide/AlGaN and AlGaN/GaN interfaces, interfacial defect oxide charges and donor charges at the surface of the AlGaN barrier. The effects of two different gate oxides (Al2O3 and HfO2) are compared for the performance evaluation of the proposed MOSHEMT. The MOSHEMTs with Al2O3 dielectric have an advantage of significant increase in 2DEG up to 1.2 × 1013 cm‑2 with an increase in oxide thickness up to 10 nm as compared to HfO2 dielectric MOSHEMT. The surface potential for HfO2 based device decreases from 2 to ‑1.6 eV within 10 nm of oxide thickness whereas for the Al2O3 based device a sharp transition of surface potential occurs from 2.8 to ‑8.3 eV. The variation in oxide thickness and gate metal work function of the proposed MOSHEMT shifts the threshold voltage from negative to positive realizing the enhanced mode operation. Further to validate the model, the device is simulated in Silvaco Technology Computer Aided Design (TCAD) showing good agreement with the proposed model results. The accuracy of the developed calculations of the proposed model can be used to develop a complete physics based 2DEG sheet charge density and threshold voltage model for GaN MOSHEMT devices for performance analysis.