The sub-energetic gamma-ray burst GRB 031203 as a cosmic analogue to the nearby GRB 980425.

Science.gov (United States)

Soderberg, A M; Kulkarni, S R; Berger, E; Fox, D W; Sako, M; Frail, D A; Gal-Yam, A; Moon, D S; Cenko, S B; Yost, S A; Phillips, M M; Persson, S E; Freedman, W L; Wyatt, P; Jayawardhana, R; Paulson, D

2004-08-05

Over the six years since the discovery of the gamma-ray burst GRB 980425, which was associated with the nearby (distance approximately 40 Mpc) supernova 1998bw, astronomers have debated fiercely the nature of this event. Relative to bursts located at cosmological distance (redshift z approximately 1), GRB 980425 was under-luminous in gamma-rays by three orders of magnitude. Radio calorimetry showed that the explosion was sub-energetic by a factor of 10. Here we report observations of the radio and X-ray afterglow of the recent GRB 031203 (refs 5-7), which has a redshift of z = 0.105. We demonstrate that it too is sub-energetic which, when taken together with the low gamma-ray luminosity, suggests that GRB 031203 is the first cosmic analogue to GRB 980425. We find no evidence that this event was a highly collimated explosion viewed off-axis. Like GRB 980425, GRB 031203 appears to be an intrinsically sub-energetic gamma-ray burst. Such sub-energetic events have faint afterglows. We expect intensive follow-up of faint bursts with smooth gamma-ray light curves (common to both GRB 031203 and 980425) to reveal a large population of such events.

Probable metal-insulator transition in Ag{sub 4}SSe

Energy Technology Data Exchange (ETDEWEB)

Drebushchak, V.A., E-mail: dva@igm.nsc.ru [V.S. Sobolev Institute of Geology and Mineralogy, SB RAS, Pr. Ac. Koptyuga 3, Novosibirsk 630090 (Russian Federation); Novosibirsk State University, Ul. Pirogova 2, Novosibirsk 630090 (Russian Federation); Pal’yanova, G.A.; Seryotkin, Yu.V. [V.S. Sobolev Institute of Geology and Mineralogy, SB RAS, Pr. Ac. Koptyuga 3, Novosibirsk 630090 (Russian Federation); Novosibirsk State University, Ul. Pirogova 2, Novosibirsk 630090 (Russian Federation); Drebushchak, T.N. [Novosibirsk State University, Ul. Pirogova 2, Novosibirsk 630090 (Russian Federation); Institute of Solid State Chemistry and Mechanochemistry, SB RAS, Ul. Kutateladze 18, Novosibirsk 630128 (Russian Federation)

2015-02-15

Highlights: • New phase transition in Ag{sub 4}SSe was discovered with scanning calorimetry and supported with X-ray powder diffraction. • The thermal effect relates to the anomaly in electrical and thermal conductivity of Ag{sub 4}SSe. • Similar thermal and electrical effects in K{sub 3}Cu{sub 8}S{sub 6} are explained with the metal-insulator transition. - Abstract: New phase transition (285 K) in low-temperature monoclinic Ag{sub 4}SSe was found out below the α-β transition (358 K) after the measurements with differential scanning calorimetry. The transition reveals significant hysteresis (over 30 K). X-ray powder diffraction shows that the superlattice with doubled a and b parameters of the unit cell exists below the new transition point. The signs of this new phase transition can be found in thermal and electrical conductivity of Ag{sub 4}SSe published in literature. Elusive phase transition in Ag{sub 2}Se shows similar properties. The new transition is likely related to the metal-insulator type transition, like K{sub 3}Cu{sub 8}S{sub 6}.

Multi-body forces and the energetics of transition metals, alloys, and semiconductors

International Nuclear Information System (INIS)

Carlsson, A.E.

1992-01-01

Progress over the past year is divided into 3 areas: potential-energy functions for transition-metal aluminides; electronic structure and energetics of complex structures and quasicrystals; and ceramic materials (PdO, PtO)

Unconventional exo selectivity in thermal normal-electron-demand Diels-Alder reactions

Science.gov (United States)

Ho, Guo-Ming; Huang, Ci-Jhang; Li, Elise Yu-Tzu; Hsu, Sheng-Kai; Wu, Ti; Zulueta, Medel Manuel L.; Wu, Kevin Binchia; Hung, Shang-Cheng

2016-10-01

The Diels-Alder reaction is a useful tool for generating functionalized chiral molecules through the concerted cycloaddition of dienes and dienophiles leading to six-membered rings. Traditionally, the selective predictions of the products rely heavily on consideration of the secondary orbital interactions that stabilize the endo pathway. However, there remain some basic examples defying this notion and produce the exo-isomer as major product. Here we systematically evaluated of the structural features driving exo selectivity in thermal normal-electron-demand Diels-Alder reactions. Substitution at the Cβ position and the size and electronegativity of the electron-withdrawing group of the dienophile are contributing factors. Experimental and computational studies both point toward the steric and electrostatic forces between the substituents in both the diene and the dienophile that increase the likelihood of the exo pathway. For these substrates, the dominance of the endo pathway is reduced by transition state distortions and poor structural alignments of the reacting partners. We also noted the tilt of the dienophile with respect to the diene causing steric strain on the functionalities at the more advanced bond forming carbon-carbon position of the endo transition state. Insights into such factors may benefit synthetic planning and asserting control over this important named reaction.

Cubic-tetragonal phase transition in Ca sub 0 sub . sub 0 sub 4 Sr sub 0 sub . sub 9 sub 6 TiO sub 3 a combined specific heat and neutron diffraction study

CERN Document Server

Gallardo, M C; Romero, F J; Cerro, J D; Seifert, F; Redfern, S A T

2003-01-01

The specific heat corresponding to the tetragonal-to-cubic transition in Ca sub 0 sub . sub 0 sub 4 Sr sub 0 sub . sub 9 sub 6 TiO sub 3 perovskite has been measured by conduction calorimetry. The order parameter of the transition has been obtained by means of neutron diffraction at low temperatures. Comparison of calorimetric data with the evolution of the order parameter indicates that this transition seems to follow a mean field Landau potential as in SrTiO sub 3. The linear behaviour of the excess of entropy versus temperature suggests that a 2-4 Landau potential is sufficient to describe the transition.

Multiple phase transitions and magnetoresistance of HoFe{sub 4}Ge{sub 2}

Energy Technology Data Exchange (ETDEWEB)

Liu, J., E-mail: liujing@iastate.edu; Pecharsky, V.K.; Gschneidner, K.A.

2015-05-15

Highlights: • Three magnetic transitions at T{sub N} = 51 K, T{sub f1} = 42 K, and T{sub f2} = 15 K. • Kinetically arrested phase below a freezing point of ∼11 K. • First-order metamagnetic transition at critical field ∼22 kOe below 35 K. • A large magnetoresistance of ∼30% at a field change of 30 kOe near 15 K. - Abstract: A systematic study of the structural, magnetic, heat capacity, electrical resistivity and magnetoresistance properties of HoFe{sub 4}Ge{sub 2} has been performed. The temperature dependencies of the magnetization and heat capacity show three magnetic transitions at T{sub N} = 51 K, T{sub f1} = 42 K, and T{sub f2} = 15 K. The high temperature transition is antiferromagnetic ordering and the two low temperature phase transitions are due to rearrangements of the magnetic structure. A kinetically arrested phase is observed below a freezing point of ∼11 K. Below 35 K, the behavior of the isothermal magnetization reflects a first-order metamagnetic phase transition. Multiple phase transitions are also manifested in the electrical resistivity behavior. For a field change of 30 kOe, a large magnetoresistance of ∼30% is observed near T{sub f2} (15 K)

Exo selective enantioselective nitrone cycloadditions.

Science.gov (United States)

Sibi, Mukund P; Ma, Zhihua; Jasperse, Craig P

2004-01-28

We have developed a novel method for accessing exo adducts with high enantioselectivity in nitrone cycloadditions to enoates. Pyrazolidinones proved to be effective achiral templates in the cycloadditions, providing exo adducts typically in >15:1 selectivity and 90-98% ee. The use of Lewis acids that form square planar complexes, such as copper triflate, was important for obtaining high exo selectivity.

Transiting exoplanets from the CoRoT space mission . VI. CoRoT-Exo-3b: the first secure inhabitant of the brown-dwarf desert

Science.gov (United States)

Deleuil, M.; Deeg, H. J.; Alonso, R.; Bouchy, F.; Rouan, D.; Auvergne, M.; Baglin, A.; Aigrain, S.; Almenara, J. M.; Barbieri, M.; Barge, P.; Bruntt, H.; Bordé, P.; Collier Cameron, A.; Csizmadia, Sz.; de La Reza, R.; Dvorak, R.; Erikson, A.; Fridlund, M.; Gandolfi, D.; Gillon, M.; Guenther, E.; Guillot, T.; Hatzes, A.; Hébrard, G.; Jorda, L.; Lammer, H.; Léger, A.; Llebaria, A.; Loeillet, B.; Mayor, M.; Mazeh, T.; Moutou, C.; Ollivier, M.; Pätzold, M.; Pont, F.; Queloz, D.; Rauer, H.; Schneider, J.; Shporer, A.; Wuchterl, G.; Zucker, S.

2008-12-01

Context: The CoRoT space mission routinely provides high-precision photometric measurements of thousands of stars that have been continuously observed for months. Aims: The discovery and characterization of the first very massive transiting planetary companion with a short orbital period is reported. Methods: A series of 34 transits was detected in the CoRoT light curve of an F3V star, observed from May to October 2007 for 152 days. The radius was accurately determined and the mass derived for this new transiting, thanks to the combined analysis of the light curve and complementary ground-based observations: high-precision radial-velocity measurements, on-off photometry, and high signal-to-noise spectroscopic observations. Results: CoRoT-Exo-3b has a radius of 1.01 ± 0.07 R_Jup and transits around its F3-type primary every 4.26 days in a synchronous orbit. Its mass of 21.66 ± 1.0 M_Jup, density of 26.4 ± 5.6 g cm-3, and surface gravity of logg = 4.72 clearly distinguish it from the regular close-in planet population, making it the most intriguing transiting substellar object discovered so far. Conclusions: With the current data, the nature of CoRoT-Exo-3b is ambiguous, as it could either be a low-mass brown-dwarf or a member of a new class of “superplanets”. Its discovery may help constrain the evolution of close-in planets and brown-dwarfs better. Finally, CoRoT-Exo-3b confirms the trend that massive transiting giant planets (M ≥ 4 M_Jup) are found preferentially around more massive stars than the Sun. The CoRoT space mission, launched on December 27th 2006, has been developed and is operating by CNES, with the contribution of Austria, Belgium, Brasil, ESA, Germany and Spain. The first CoRoT data will be available to the public in February 2009 from the CoRoT archive: http://idoc-corot.ias.u-psud.fr/ Table of the COROT photometry is only available in electronic form at the CDS via anonymous ftp to cdsarc.u-strasbg.fr (130.79.128.5) or via http

Interchannel interactions in high-energetic radiationless transitions of neon-like ions

International Nuclear Information System (INIS)

Fritzsche, S.; Zschornack, G.; Musiol, G.; Soff, G.

1990-07-01

Relativistic K-LL Auger transition rates in intermediate coupling including interchannel interactions are presented for nine ions in the neon-isoelectronic sequence up to uranium. For neutral neon a comparison with experimental data is given. We demonstrate for the first time, that intercontinuum interactions result in a remarkable redistribution of individual transition rates even in high-energetic transitions. For instance, channel mixing shifts the K-L 1 L 1 rate by about 4% and the K-L 3 L 3 (J = 0) rate by about 11% in neon-like uranium, while total Auger rates are almost not affected. (orig.)

Theory of structural phase transition in MgTi{sub 2}O{sub 4}

Energy Technology Data Exchange (ETDEWEB)

Talanov, V. M., E-mail: valtalanov@mail.ru [South Russian State Polytechnical University (Russian Federation); Shirokov, V. B. [Russian Academy of Sciences, South Science Centre (Russian Federation); Ivanov, V. V. [South Russian State Polytechnical University (Russian Federation); Talanov, M. V. [South Federal University (Russian Federation)

2015-01-15

A theory of phase transition in MgTi{sub 2}O{sub 4} is proposed based on a study of the order-parameter symmetry, thermodynamics, and mechanisms of formation of the atomic and orbital structure of the low-symmetry MgTi{sub 2}O{sub 4} phase. The critical order parameter (which induces a phase transition) is determined. It is shown that the calculated MgTi{sub 2}O{sub 4} tetragonal structure is a result of displacements of magnesium, titanium, and oxygen atoms; ordering of oxygen atoms; and the participation of d{sub xy}, d{sub xz}, and d{sub yz} orbitals. The contribution of noncritical representations to ion displacements is proven to be insignificant. The existence of various metal clusters in the tetragonal phase has been established by calculation in correspondence with experimental data. It is shown (within the Landau theory of phase transitions) that phase states can be changed as a result of both first- and second-order phase transitions: the high-symmetry phase borders two low-symmetry phases by second-order transition lines, while the border between low-symmetry phases is a first-order transition line.

On the Properties of the s{sub 1/2} -> d{sub 3/2} Transition in {sup 199}Au

Energy Technology Data Exchange (ETDEWEB)

Baecklin, A [Swedish Research Councils' Laboratory, Studsvik, Nykoeping (Sweden); Malmskog, S G [AB Atomenergi, Nykoeping (Sweden)

1967-02-15

The half-life of the first excited level in Au has been measured by the delayed coincidence technique to be 1.1 {+-} 0.1 nsec. From a measurement of the intensity ratios of the L sub shell conversion lines the E2/M1 ratio of the deexciting transition has been found to be (4.9 {sup +1.4}{sub -0.8})10{sup -2} The energy of the transition was measured to 77.21 {+-} 0.03 keV. The absolute values of the reduced M1 and E2 transition probabilities have been calculated and included in a systematic survey of s{sub 1/2} <-> d{sub 3/2} transitions in odd Z isotopes in the Au region. This result has been compared with the predictions of the nuclear models of Sorensen and de Shalit.

Evidence of spin transition and charge order in cobalt substituted La sub 0 sub . sub 7 Ca sub 0 sub . sub 3 MnO sub 3

CERN Document Server

Srivastava, C M; Gundurao, T K; Nigam, A K; Bahadur, D

2003-01-01

The transport and magnetic studies of a series of compounds having the general formula La sub 0 sub . sub 7 Ca sub 0 sub . sub 3 Mn sub 1 sub - sub x Co sub x O sub 3 (0.1 = 0.25 there is a clear spin transition at low temperature from the high to the low spin state of trivalent cobalt and this leads to change in ferromagnetic (FM) and antiferromagnetic (AFM) phases. For x >= 0.25 there are two transitions for each value of x: the upper one gives the FM and AFM spin arrangement depending upon whether the DE or the SE dominates; the lower one is obtained due to the transition from the high to the low spin state of the trivalent cobalt ion.

Exo-endo cellulase fusion protein

Science.gov (United States)

Bower, Benjamin S [Palo Alto, CA; Larenas, Edmund A [Palo Alto, CA; Mitchinson, Colin [Palo Alto, CA

2012-01-17

The present invention relates to a heterologous exo-endo cellulase fusion construct, which encodes a fusion protein having cellulolytic activity comprising a catalytic domain derived from a fungal exo-cellobiohydrolase and a catalytic domain derived from an endoglucanase. The invention also relates to vectors and fungal host cells comprising the heterologous exo-endo cellulase fusion construct as well as methods for producing a cellulase fusion protein and enzymatic cellulase compositions.

High pressure antiferrodistortive phase transition in mixed crystals of EuTiO{sub 3} and SrTiO{sub 3}

Energy Technology Data Exchange (ETDEWEB)

Parisiades, Paraskevas, E-mail: paraskevas.parisiadis@univ-paris-diderot.fr [Laboratoire Matériaux et Phénoménes Quantiques (UMR 7162 CNRS), Université Paris Diderot-Paris 7, Paris Cedex 13 (France); ID27 Beamline, European Synchrotron Radiation Facility, 71 Avenue des Martyrs, 38000 Grenoble (France); Saltarelli, Francesco [Sapienza University of Rome, Physics Dept., Piazzale Aldo Moro 5, 00185 Roma (Italy); Liarokapis, Efthymios [Department of Physics, National Technical University of Athens, GR-15780 Athens (Greece); Köhler, Jürgen; Bussmann-Holder, Annette [Max-Planck-Institute for Solid State Research, Heisenbergstrasse 1, D-70569 Stuttgart (Germany)

2016-06-15

We report a detailed high pressure study on Eu{sub 1−x}Sr{sub x}TiO{sub 3} polycrystalline samples using synchrotron x-ray diffraction. We have observed a second-order antiferrodistortive phase transition for all doping levels which corresponds to the transition that has been previously explored as a function of temperature. The analysis of the compression mechanism by calculating the lattice parameters, spontaneous strains and tilt angles of the TiO{sub 6} octahedra leads to a high pressure phase diagram for Eu{sub 1−x}Sr{sub x}TiO{sub 3}.

Critical Behavior of Thermal Expansion and Magnetostriction in the Vicinity of the First order transition at the Curie Point of Gd<sub>5sub>(Si_xGe>1-xsub>)>4sub>

Energy Technology Data Exchange (ETDEWEB)

Han, Mangui [Iowa State Univ., Ames, IA (United States)

2004-01-01

Thermal expansion (TE) and magnetostriction (MS) measurements have been conducted for Gd<sub>5sub>(Si_xGe>1-xsub>)>4sub> with a series of x values to study its critical behavior in the vicinity of transition temperatures. It was found that the Curie temperature of Gd<sub>5sub>(Si_xGe>1-xsub>)>4sub> for x 0 ~ 0.5 is dependent on magnetic field, direction of change of temperature (Tc on cooling was lower than Tc on heating), purity of Gd starting material, compositions, material preparation methods, and also can be triggered by the external magnetic field with a different dT/dB rate for different x values. For Gd<sub>5sub>(Si>1.95sub>Ge>2.05sub>), Gd<sub>5sub>(Si>2sub>Ge>2sub>), Gd<sub>5sub>(Si>2.09sub>Ge>1.91sub>), it was also found that the transition is a first order magneto-structural transition, which means the magnetic transition and crystalline structure transition occur simultaneously, and completely reversible. Temperature hysteresis and phase coexistence have been found to confirm that it is a first order transformation. While for Gd<sub>5sub>(Si>0.15sub>Ge>3.85sub>), it is partially reversible at some temperature range between the antiferromagnetic and the ferromagnetic state. For Gd<sub>5sub>(Si>2.3sub>Ge>1.7sub>) and Gd<sub>5sub>(Si>3sub>Ge>1sub>), it was a second order transformation between the paramagnetic and ferromagnetic state, because no ΔT have been found. Giant magnetostriction was only found on Gd<sub>5sub>(Si>1.95sub>Ge>2.05sub>), Gd<sub>5sub>(Si>2sub>Ge>2sub>), Gd<sub>5sub>(Si>2.09sub>Ge>1.91sub>) in their vicinity of first order transformation. MFM images have also been taken on polycrystal sample Gd<sub>5sub>(Si>2.09sub>Ge>1.91sub>) to investigate the transformation process. The results also indicates that the Curie temperature was lower and the thermally

Electronic and magnetic properties of 1T-HfS{sub 2} by doping transition-metal atoms

Energy Technology Data Exchange (ETDEWEB)

Zhao, Xu, E-mail: zhaoxu@htu.cn [College of Physics and Electronic Engineering, Henan Normal University, Xinxiang, Henan 453007 (China); Wang, Tianxing; Wang, Guangtao [College of Physics and Electronic Engineering, Henan Normal University, Xinxiang, Henan 453007 (China); Dai, Xianqi [College of Physics and Electronic Engineering, Henan Normal University, Xinxiang, Henan 453007 (China); Department of Physics, Zhengzhou Normal University, Zhengzhou, Henan 450044 (China); Xia, Congxin [College of Physics and Electronic Engineering, Henan Normal University, Xinxiang, Henan 453007 (China); Yang, Lin [School of Chemistry and Chemical Engineering, Henan Normal University, Xinxiang 453007 (China)

2016-10-15

Highlights: • Pristine 1T-HfS{sub 2} is a semiconductor with indirect gaps of 1.250 eV • Magnetism can be observed for V, Cr, Mn, Fe, Co, and Cu doping. • Strong p–d hybridization was found between TM 3d orbitals and S 3p orbitals. • V-doped 1T-HfS{sub 2} is ideal for spin injection. - Abstract: We explored the electronic and magnetic properties of 1T-HfS{sub 2} doped by transition metal (TM) atom using the first-principles calculation. We doped the transition metal atoms from the IIIB to VIB groups in nonmagnetic 1T-HfS{sub 2}. Numerical results show that the pristine 1T-HfS{sub 2} is a semiconductor with indirect gaps of 1.250 eV. Magnetism can be observed for V, Cr, Mn, Fe, Co, and Cu doping. The polarized charges mainly arise from the localized 3d electrons of the TM atom. The strong p–d hybridization was found between the 3d orbitals of TM and 3p orbitals of S. The substituted 1T-HfS{sub 2} can be a metal, semiconductor or half-metal. Analysis of the band structure and magnetic properties indicates that TM-doped HfS{sub 2} (TM = V, Fe, Cu) are promising systems to explore two-dimensional diluted magnetic semiconductors. The formation energy calculations also indicate that it is energetically favorable and relatively easier to incorporate transition metal atom into the HfS{sub 2} under S-rich experimental conditions. In contrast, V-doped HfS{sub 2} has relatively wide half-metallic gap and low formation energy. So V-doped 1T-HfS{sub 2} is ideal for spin injection, which is important for application in semiconductor spintronics.

Comparing magnetostructural transitions in Ni{sub 50}Mn{sub 18.75}Cu{sub 6.25}Ga{sub 25} and Ni{sub 49.80}Mn{sub 34.66}In{sub 15.54} Heusler alloys

Energy Technology Data Exchange (ETDEWEB)

Dubenko, Igor [Department of Physics, Southern Illinois University, Carbondale, IL 62901 (United States); Granovsky, Alexander [Faculty of Physics, Lomonosov Moscow State University, Moscow 119991 (Russian Federation); Lahderanta, Erkki [Lappeenranta University of Technology, 53851 (Finland); Kashirin, Maxim; Makagonov, Vladimir [Voronezh State Technical University, Voronezh 394026 (Russian Federation); Aryal, Anil; Quetz, Abdiel; Pandey, Sudip [Department of Physics, Southern Illinois University, Carbondale, IL 62901 (United States); Rodionov, Igor [Faculty of Physics, Lomonosov Moscow State University, Moscow 119991 (Russian Federation); Samanta, Tapas; Stadler, Shane [Department of Physics & Astronomy, Louisiana State University, Baton Rouge, LA 70803 (United States); Mazumdar, Dipanjan, E-mail: dmazumdar@siu.edu [Department of Physics, Southern Illinois University, Carbondale, IL 62901 (United States); Ali, Naushad [Department of Physics, Southern Illinois University, Carbondale, IL 62901 (United States)

2016-03-01

The crystal structure, magnetic and transport properties, including resistivity and thermopower, of Ni{sub 50}Mn{sub 18.75}Cu{sub 6.25}Ga{sub 25} and Ni{sub 49.80}Mn{sub 34.66}In{sub 15.54} Heusler alloys were studied in the (10–400) K temperature interval. We show that their physical properties are remarkably different, thereby pointing to different origin of their magnetostructural transition (MST). A Seebeck coefficient (S) was found to pass minimum of about −20 µV/K in respect of temperature for both compounds. It was shown that MST observed for both compounds results in jump-like changes in S for Ga-based compound and jump in resistivity of about 20 and 200 µΩ cm for Ga and In –based compounds, respectively. The combined analyzes of the present results with that from literature show that the density of states at the Fermi level does not change strongly at the MST in the case of Ni–Mn–In alloys as compared to that of Ni–Mn–Ga. - Graphical abstract: Temperature dependencies of resistivity for Ni{sub 50}Mn{sub 18.75}Cu{sub 6.25}Ga{sub 25} and Ni{sub 49.80}Mn{sub 34.66}In{sub 15.54} obtained on heating (open symbols) and cooling (closed symbols). Arrows indicate the temperature of direct (T{sub M}) and inverse (T{sub A}) martensitic transitions and ferromagnetic ordering of the austenitic (T{sub C}) and martensitic (T{sub CM}) phases. The T{sub CM}=T{sub A}/T{sub M} in the case of Ga-based alloy. - Highlights: • Magnetostructural transitions (MST) in two compounds with same parent material. • The figure exemplifies how sensitive MST properties are to the density of states. • Proper understanding is required for utilizing these multifunctional materials.

Maximizing the ExoEarth candidate yield from a future direct imaging mission

International Nuclear Information System (INIS)

Stark, Christopher C.; Roberge, Aki; Mandell, Avi; Robinson, Tyler D.

2014-01-01

ExoEarth yield is a critical science metric for future exoplanet imaging missions. Here we estimate exoEarth candidate yield using single visit completeness for a variety of mission design and astrophysical parameters. We review the methods used in previous yield calculations and show that the method choice can significantly impact yield estimates as well as how the yield responds to mission parameters. We introduce a method, called Altruistic Yield Optimization, that optimizes the target list and exposure times to maximize mission yield, adapts maximally to changes in mission parameters, and increases exoEarth candidate yield by up to 100% compared to previous methods. We use Altruistic Yield Optimization to estimate exoEarth candidate yield for a large suite of mission and astrophysical parameters using single visit completeness. We find that exoEarth candidate yield is most sensitive to telescope diameter, followed by coronagraph inner working angle, followed by coronagraph contrast, and finally coronagraph contrast noise floor. We find a surprisingly weak dependence of exoEarth candidate yield on exozodi level. Additionally, we provide a quantitative approach to defining a yield goal for future exoEarth-imaging missions.

Thermal properties and phase transition in the fluoride, (NH{sub 4}){sub 3}SnF{sub 7}

Energy Technology Data Exchange (ETDEWEB)

Kartashev, A.V. [Kirensky Institute of Physics, Siberian Department of the Russian Academy of Sciences, 660036 Krasnoyarsk (Russian Federation); Astafijev Krasnoyarsk State Pedagogical University, 660049 Krasnoyarsk (Russian Federation); Gorev, M.V. [Kirensky Institute of Physics, Siberian Department of the Russian Academy of Sciences, 660036 Krasnoyarsk (Russian Federation); Institute of Engineering Physics and Radio Electronics, Siberian State University, 660074 Krasnoyarsk (Russian Federation); Bogdanov, E.V. [Kirensky Institute of Physics, Siberian Department of the Russian Academy of Sciences, 660036 Krasnoyarsk (Russian Federation); Krasnoyarsk State Agrarian University, 660049 Krasnoyarsk (Russian Federation); Flerov, I.N. [Kirensky Institute of Physics, Siberian Department of the Russian Academy of Sciences, 660036 Krasnoyarsk (Russian Federation); Institute of Engineering Physics and Radio Electronics, Siberian State University, 660074 Krasnoyarsk (Russian Federation); Laptash, N.M. [Institute of Chemistry, Far Eastern Department of the Russian Academy of Sciences, 690022 Vladivostok (Russian Federation)

2016-05-15

Calorimetric, dilatometric and differential thermal analysis studies were performed on (NH{sub 4}){sub 3}SnF{sub 7} for a wide range of temperatures and pressures. Large entropy (δS{sub 0}=22 J/mol K) and elastic deformation (δ(ΔV/V){sub 0}=0.89%) jumps have proven that the Pa-3↔Pm-3m phase transition is a strong first order structural transformation. A total entropy change of ΔS{sub 0}=32.5 J/mol K is characteristic for the order–disorder phase transition, and is equal to the sum of entropy changes in the related material, (NH{sub 4}){sub 3}TiF{sub 7}, undergoing transformation between the two cubic phases through the intermediate phases. Hydrostatic pressure decreases the stability of the high temperature Pm-3m phase in (NH{sub 4}){sub 3}SnF{sub 7}, contrary to (NH{sub 4}){sub 3}TiF{sub 7}, characterised by a negative baric coefficient. The effect of experimental conditions on the chemical stability of (NH{sub 4}){sub 3}SnF{sub 7} was observed. - Graphical abstract: Strong first order structural transformation Pa-3↔Pm-3m in (NH{sub 4}){sub 3}SnF{sub 7} is associated with very large total entropy change of ΔS{sub 0}=32.5 J/mol K characteristic for the ordering processes and equal to the sum of entropy changes in the related (NH{sub 4}){sub 3}TiF{sub 7} undergoing transformation between the same two cubic phases through the intermediate phases. - Highlights: • (NH{sub 4}){sub 3}SnF{sub 7} undergoes strong first order Pa-3↔Pm-3m phase transition. • Anomalous behaviour of ΔC{sub p} and ΔV/V exists far below phase transition temperature. • Structural distortions are accompanied by huge total entropy change ΔS≈Rln50. • High pressure strongly increases the stability of Pa-3 phase in (NH{sub 4}){sub 3}SnF{sub 7}. • Entropy of the Pa-3↔Pm-3m phase transition does not depend on pressure.

ExoCross: Spectra from molecular line lists

Science.gov (United States)

Yurchenko, Sergei N.; Al-Refaie, Ahmed; Tennyson, Jonathan

2018-03-01

ExoCross generates spectra and thermodynamic properties from molecular line lists in ExoMol, HITRAN, or several other formats. The code is parallelized and also shows a high degree of vectorization; it works with line profiles such as Doppler, Lorentzian and Voigt and supports several broadening schemes. ExoCross is also capable of working with the recently proposed method of super-lines. It supports calculations of lifetimes, cooling functions, specific heats and other properties. ExoCross converts between different formats, such as HITRAN, ExoMol and Phoenix, and simulates non-LTE spectra using a simple two-temperature approach. Different electronic, vibronic or vibrational bands can be simulated separately using an efficient filtering scheme based on the quantum numbers.

Identification of high-energetic particles by transition radiation

International Nuclear Information System (INIS)

Struczinski, W.

1986-01-01

This thesis gives a comprehensive survey on the application of the transition radiation for the particle identification. After a short historical review on the prediction and the detection of the transition radiation its theoretical foundations are more precisely explained. They form the foundations for the construction of an optimal transition radiation detector the principal construction of which is described. The next chapter shows some experiments by which the main predictions of the transition-radiation theory are confirmed. Then the construction and operation of two transition-radiation detectors are described which were applied at the ISR respectively SPS in the CERN in Geneva in complex experiments. The detector applied at the ISR served for the e ± identification. With two lithium radiators which were followed by xenon-filled proportional chambers an e/π separation of ≅ 10 -2 could be reached. The transition-radiation detector applied in the SPS was integrated into the European Hybrid Spectrometer. It served for the identification of high-energetic pions (> or approx. 90 GeV) against kaons and protons. With twenty units of carbon-fiber radiators which were followed by xenon-filled proportional chambers a π/K, p separation of better than 1:20 for momenta above 100 GeV could be reached. The cluster-counting method is then presented. Finally, a survey on the contemporary status in the development of transition-radiation detectors for the e/π separation is given. It is shown that by an about half a meter long detector the radiators of which consist of carbon fibers an e/π separation in the order of magnitude of ≅ 10 -2 can be reached. (orig./HSI) [de

Characterization of extra-solar planets and their atmospheres (Spectroscopy of transits and atmospheric escape)

International Nuclear Information System (INIS)

Bourrier, Vincent

2014-01-01

Hot Jupiters are exo-planets so close to their star that their atmosphere can lose gas because of hydrodynamic escape. Transiting gaseous giants are an excellent way to understand this mechanism, but it is necessary to study other types of planets to determine its impact on the exo-planetary population. This thesis aims at using transit spectroscopy to observe the atmosphere of several exo-planets, to study their properties and to contribute to the characterization of hydrodynamic escape. UV lines observed with the Hubble telescope are analyzed with the numerical model of upper atmospheres we developed. Using the Ly-α line we identify energetic and dynamical interactions between the atmospheres of the hot Jupiters HD209458b and HD189733b and their stars. We study the dependence of the escape on the environment of a planet and on its physical properties, through the observation of a super-Earth and a warm Jupiter in the 55 Cnc system. Using observations of HD209458b, we show that magnesium lines are a window on the region of formation of hydrodynamic escape. We study the potential of transit spectroscopy in the near-UV to detect new cases of atmospheric escape. This mechanism is fostered by the proximity of a planet to its star, which makes it even more important to understand the formation and migration processes that can be traced in the alignment of a planetary system. Using measures from the spectrographs HARPS-N and SOPHIE we study the alignments of 55 Cnc e and the Kepler candidate KOI 12.01, whose planetary nature we also seek to validate. (author)

Gold Cluster Diffusion Kinetics on Stoichiometric and Reduced Surfaces of Rutile TiO <sub>2sub> (110)

Energy Technology Data Exchange (ETDEWEB)

Goldman, Nir; Browning, Nigel D.

2011-06-16

Gold clusters on rutile TiO<sub>2sub> are known to serve as efficient oxidation catalysts for pollutants and environmental contaminants. However, the mechanism by which highly mobile small clusters migrate and aggregate into larger species relevant to gold’s catalytic activity remains unresolved. We report herein on ab initio simulations of the diffusion of atomic gold clusters up to the trimer on rutile TiO<sub>2sub>(110) surfaces. We show that, on the stoichiometric surface, both the dimer and the trimer can exhibit relatively low surface mobility due to high energetic barriers for diffusion out of their energetic minima coupled with low barriers for the reverse motion. On the reduced surface, these clusters can diffuse relatively quickly between energetic minima within the oxygen vacancy site due to the large degree of vibrational entropy in their transition states. Our computed diffusion times provide a point of comparison for future experiments and will aid in development of models of gold cluster island sintering.

Symmetry-Breaking Transitions in RECuAs<sub>2-xsub>P_{x> (RE=Sm, Gd, Ho, and Er)}

Energy Technology Data Exchange (ETDEWEB)

Mozharivskyj, Yurij [Iowa State Univ., Ames, IA (United States)

2002-01-01

Structural changes resulting in lower symmetries can be understood in terms of electronic instabilities and Coulomb interactions. The interplay of these two interrelated factors is complicated and difficult to analyze. The RECuAs<sub>2-xsub>P> xsub> phases, because of the variation in the chemical content (As/P substitution), allow, with the aid of band structures, Madelung energies and Landau theory, a partial unraveling of the forces important in the symmetry-breaking transitions in RECuAs<sub>2-xsub>P> xsub> (RE = Sm, Gd, Ho and Er). Distortions of the P layers in SmCu<sub>1.15sub>P>2sub>, GdCuP<sub>2.20sub> and ErCuP<sub>2sub> are usefully thought of as generalized Peierls distortions, i.e., they lower the electronic (and total) energy and lead to more stable structures. On the other hand, the P4/nmm → Pmmn transitions, which are observed in all studied arsenophosphide series and occur upon substitution of P for As, originate from the B1g vibrational mode and are structural adaptations to smaller P atoms. These transitions provide tighter atomic packing and better Coulomb interactions. Configurational contribution to the entropy becomes important in stabilizing the mixed occupancy in the RECuAs <sub>2-xsub>P> xsub> arsenophosphides. While geometric and electronic factors favor separation of the As and P atoms over two different crystallographic sites, configurational entropy stabilizes the As/P mixing on these two sites.;Progress in the research on RECuAs<sub>2-xsub>P> xsub> was dependent upon the ability of Landau theory to predict, explain and dismiss structural models and transitions. The space group Pmmn (arising from the B 1g vibrational mode) in all mixed arsenophosphides and the existence of these mixed arsenophosphides followed from the analysis of GdCuAs <sub>2sub> and GdCuP<sub>2sub>, using Landau theory. The impossibility of obtaining the high-symmetry structure (P4/nmm) and the low symmetry structure

Latest results from EXO-200

International Nuclear Information System (INIS)

TOSI, D.

2014-01-01

The Enriched Xenon Observatory (EXO) is an experimental program searching for neutrino-less double beta decay in xenon-136. The first stage of this program, EXO-200, has been in operation since early 2011. I present here the latest physics results from the experiment.

Theory of high-T sub c superconductivity based on the fermion-condensation quantum phase transition

CERN Document Server

Amusia, M Ya; Shaginyan, V R

2001-01-01

A theory of high temperature superconductivity based on the combination of the fermion-condensation quantum phase transition and the conventional theory of superconductivity is presented. This theory describes maximum values of the superconducting gap which can be as big as DELTA sub 1 approx 0.1 epsilon sub F , with epsilon sub F being the Fermi level. It is shown that the critical temperature 2T sub c approx = DELTA sub 1. If there exists the pseudogap above T sub c then 2T* approx = DELTA sub 1 , and T* is the temperature at which the pseudogap vanished. A discontinuity in the specific heat at T sub c is calculated. The transition from conventional superconductors to high-T sub c ones as a function of the doping level is investigated

Synthesis of Precursors of the Agalacto (Exo) Fragment of the Quartromicins via an Auxiliary-Controlled Exo-Selective Diels-Alder Reaction

Science.gov (United States)

Qi, Jun; Roush, William R.

2008-01-01

A direct synthesis of the α-hydroxyaldehyde exo-5, a precursor of the exo-spirotetronate subunit o f the quartromicins, was achieved through an exo-selective Lewis acid-catalyzed Diels-Alder reaction of dienophile 12a and diene 1. PMID:16774259

Implantation of energetic D{sup +} ions into carbon dioxide ices and implications for our solar system: formation of D{sub 2}O and D{sub 2}CO{sub 3}

Energy Technology Data Exchange (ETDEWEB)

Bennett, Chris J.; Ennis, Courtney P.; Kaiser, Ralf I., E-mail: ralfk@hawaii.edu [Department of Chemistry, University of Hawai' i at Mānoa, Honolulu, HI 96822 (United States)

2014-10-10

Carbon dioxide (CO{sub 2}) ices were irradiated with energetic D{sup +} ions to simulate the exposure of oxygen-bearing solar system ices to energetic protons from the solar wind and magnetospheric sources. The formation of species was observed online and in situ by exploiting FTIR spectroscopy. Molecular products include ozone (O{sub 3}), carbon oxides (CO{sub 3}(C {sub 2v}, D {sub 3h}), CO{sub 4}, CO{sub 5}, CO{sub 6}), D2-water (D{sub 2}O), and D2-carbonic acid (D{sub 2}CO{sub 3}). Species released into the gas phase were sampled via a quadrupole mass spectrometer, and possible minor contributions from D2-formaldehyde (D{sub 2}CO), D4-methanol (CD{sub 3}OD), and D2-formic acid (DCOOD) were additionally identified. The feasibility of several reaction networks was investigated by determining their ability to fit the observed temporal column densities of 10 key species that were quantified during the irradiation period. Directly relevant to the CO{sub 2}-bearing ices of comets, icy satellites in the outer solar system, and the ice caps on Mars, this work illustrates for the first time that D2-water is formed as a product of the exposure of CO{sub 2} ices to D{sup +} ions. These findings provide strong support for water formation from oxygen-bearing materials via non-thermal hydrogen atoms, and predict reaction pathways that are likely to be unfolding on the surfaces of asteroids and the Moon.

Magnetic transition induced by mechanical deformation in Fe{sub 60}Al{sub 40−x}Si{sub x} ternary alloys

Energy Technology Data Exchange (ETDEWEB)

Legarra, E., E-mail: estibaliz.legarra@ehu.es [Dpto. Electricidad y Electronica, Universidad del Pais Vasco (UPV/EHU), CP. 644, 48080 Bilbao (Spain); Apiñaniz, E. [Dpto. Fisica Aplicada I, Universidad del Pais Vasco, Alameda de Urquijo s/n, 48013 Bilbao (Spain); Plazaola, F. [Dpto. Electricidad y Electronica, Universidad del Pais Vasco (UPV/EHU), CP. 644, 48080 Bilbao (Spain); Jimenez, J.A. [Centro Nacional de Investigaciones Metalurgicas (CENIM), Avda. Gregorio del amo 8, 28040 Madrid (Spain)

2014-02-15

Highlights: • Fe{sub 60}Al{sub 40−x}Si{sub x} alloys were disordered by means of planetary ball milling technique. • Paramagnetic to ferromagnetic transition is observed with disordering. • Si addition hinders the disordering process and the increase of the lattice parameter. • Si addition promotes the paramagnetic to ferromagnetic transition. -- Abstract: We have used Mössbauer spectroscopy and X-ray diffraction to study the influence of different Al/Si ratios on the structural and magnetic properties of the mechanically deformed Fe{sub 60}Al{sub 40−x}Si{sub x} alloys. The results indicate that ternary alloys also present the magnetic transition with disordering observed in binary Fe{sub 60}Al{sub 40} alloys. Besides, Si introduction has two opposite contributions. From a structural point of view, hinders the disordering process, but, from a magnetic point of view promotes the magnetic transition.

Energetic, spectral, and temporal characteristics of a two-wave CO/sub 2/ laser

Energy Technology Data Exchange (ETDEWEB)

Bertel' , I.M.; Petukhov, V.O.; Prokopov, A.P.; Tochitskii, S.Ya.; Churakov, V.V.

1987-09-01

This work studies the energetic and temporal parameters of a pulsed two-wave TEA CO/sub 2/ laser's radiation and the means for controlling these parameters. Obtaining the two-wave generation regime in CO/sub 2/ lasers uses, as is known, spatial splitting of the radiation, different variants of operating diffraction gratings, and placing a cell with selectively absorbing gas in the resonator. To realize the simultaneous two-wave generation regime in the present work, a double-resonant scheme is used with mutually orthogonal polarizers to spatially separate the radiation.

Progress Towards a Benchtop Energetics Capability (BRIEFING CHARTS)

National Research Council Canada - National Science Library

Fajardo, Mario E; Lewis, William K

2006-01-01

The incorporation of nanometric (sub-micron size) metal fuel and oxidizer particles into energetic materials is a promising approach to increasing significantly the systems-level performance of munitions...

Critical end point of the first-order ferromagnetic transition in a Sm{sub 0.55}(Sr{sub 0.5}Ca{sub 0.5}){sub 0.45}MnO{sub 3} single crystal

Energy Technology Data Exchange (ETDEWEB)

Radheep, D. Mohan [Centre for High Pressure Research, School of Physics, Bharathidasan University, Tiruchirappalli 620 024 (India); Sarkar, P. [Department of Physics, Serampore College, Serampore 712 201 (India); Arumugam, S. [Centre for High Pressure Research, School of Physics, Bharathidasan University, Tiruchirappalli 620 024 (India); Suryanarayanan, R. [Laboratoire de Physico-Chimie de l' Etat Solide, ICMMO, CNRS, UMR8182, Universite Paris-Sud, 91405 Orsay (France); Mandal, P., E-mail: prabhat.mandal@saha.ac.in [Saha Institute of Nuclear Physics, 1/AF Bidhannagar, Calcutta 700 064 (India)

2014-09-01

We report on the magnetic field (H) and hydrostatic pressure (P) dependence of the order of the ferromagnetic (FM) to paramagnetic phase transition in a Sm{sub 0.55}(Sr{sub 0.5}Ca{sub 0.5}){sub 0.45}MnO{sub 3} single crystal. At ambient condition, the system exhibits a first-order FM transition at T{sub C}≈82K (in heating cycle) with strong thermal hysteresis (∼13 K). The application of external H and P increases T{sub C}, suppresses the hysteresis width, and thus weakens the first-order nature of the transition. Our analysis reveals that the hysteresis vanishes and the first-order FM transition becomes a crossover above a critical magnetic field H{sub cr}≈11.5T. The value of H{sub cr} is highest among the manganite family, although the first-order nature of the FM transition is believed to be strongest in Eu{sub 1−x}Sr{sub x}MnO{sub 3}(x≈0.45). - Highlights: • System shows a strong first-order ferromagnetic to paramagnetic phase transition. • Extremely sharp metal–insulator transition at around 82 K. • The value of critical magnetic field at which first-order transition becomes a crossover is highest among manganites. • The nature of transition is sensitive to external perturbations such as magnetic field and pressure.

Electrical properties and phase transition of Ba(Zr{sub 0.05}Ti{sub 0.95}){sub 1−x}(Fe{sub 0.5}Ta{sub 0.5}){sub x}O{sub 3} ceramics

Energy Technology Data Exchange (ETDEWEB)

Kruea-In, C. [Faculty of Science and Technology, Chiang Mai Rajabhat University (Thailand); Rujijanagul, G., E-mail: rujijanagul@yahoo.com [Department of Physics and Materials Science, Faculty of Science, Chiang Mai University (Thailand)

2015-09-15

Highlights: • Properties of of Ba(Zr{sub 0.05}Ti{sub 0.95}){sub 1−x}(Fe{sub 0.5}Ta{sub 0.5}){sub x}O{sub 3} ceramics were investigated. • Small amount of dopant produced a large change in dielectric and phase transition. • A phase diagram of Ba(Zr{sub 0.05}Ti{sub 0.95}){sub 1−x}(Fe{sub 0.5}Ta{sub 0.5}){sub x}O{sub 3} ceramics was proposed. • Dielectric tunability increased with increasing x concentration. - Abstract: In this work, properties of Ba(Zr{sub 0.05}Ti{sub 0.95}){sub 1−x}(Fe{sub 0.5}Ta{sub 0.5}){sub x}O{sub 3} ceramics with 0.00≤ x ≤0.07 were investigated. The ceramics were fabricated by a solid state reaction technique. X-ray diffraction analysis indicated that all samples exhibited single phase perovskite. Examination of the dielectric spectra revealed that the Fe and Ta additives promoted a diffuse phase transition, and the two phase transition temperatures, as observed in the dielectric curve of pure Ba(Zr{sub 0.05}Ti{sub 0.95})O{sub 3}, merged into a single phase transition temperature for higher x concentrations. The transformation was confirmed by ferroelectric measurements. In addition, the doped ceramics exhibited high relative dielectric tunability, especially for higher x concentration samples.

Pressure-induced phase transitions in acentric BaHf(BO{sub 3}){sub 2}

Energy Technology Data Exchange (ETDEWEB)

Mączka, Mirosław, E-mail: m.maczka@int.pan.wroc.pl [Institute of Low Temperature and Structure Research, Polish Academy of Sciences, P.O. Box 1410, 50-950 Wrocław 2 (Poland); Szymborska-Małek, Katarzyna [Institute of Low Temperature and Structure Research, Polish Academy of Sciences, P.O. Box 1410, 50-950 Wrocław 2 (Poland); Sousa Pinheiro, Gardenia de [Departamento de Física, Universidade Federal do Piauí, Teresina, PI 64049-550 (Brazil); Cavalcante Freire, Paulo Tarso [Departamento de Fisica, Universidade Federal do Ceara, Fortaleza CE-60455-970 (Brazil); Majchrowski, Andrzej [Institute of Applied Physics, Military University of Technology, 2 Kaliskiego Street, 00-908 Warszawa (Poland)

2015-08-15

High-pressure Raman scattering studies revealed that BaHf(BO{sub 3}){sub 2} is more compressible than calcite-type orthoborates and calcite, aragonite or dolomite carbonates. It undergoes a first-order reversible pressure-induced phase transition in the 3.9–4.4 GPa pressure range. Second structural change is observed at 9.2 GPa. The intermediate phase is most likely trigonal. However, Raman results suggest increase in the number of distinct BO{sub 3} groups from two in the ambient pressure phase to at least three in the intermediate phase. This intermediate phase is also strongly compressible and strong pressure dependence of the lattice modes proves that the main changes under pressure occur within the layers built from BaO{sub 6} and HfO{sub 6} octahedra. The second phase transition leads most likely to lowering of the trigonal symmetry, as evidenced by significant increase of the number of observed bands. The pressure coefficients of the Raman bands of the high-pressure phase are relatively small, suggesting more dense arrangement of the metal–oxygen polyhedra and BO{sub 3} groups in this phase. It is worth noting that the high-pressure phase was not reached in the second compression experiment up to 10 GPa. This behavior can be most likely attributed to worse hydrostatic conditions of the first experiment. - Graphical abstract: Raman spectra of BaHf(BO{sub 3}){sub 2} recorded at different pressures during compression showing onset of pressure-induced phase transitions. - Highlights: • High-pressure Raman spectra were measured for BaHf(BO{sub 3}){sub 2.} • BaHf(BO{sub 3}){sub 2} undergoes a reversible first-order phase transition at 3.9–4.4 GPa into a trigonal phase. • The intermediate trigonal phase is strongly compressible second structural transformation is observed at 9.2 GPa under non-perfect hydrostatic conditions.

Phase transitions during formation of Ag nanoparticles on In{sub 2}S{sub 3} precursor layers

Energy Technology Data Exchange (ETDEWEB)

Liu, Yang, E-mail: yang.liu@helmholtz-berlin.de; Fu, Yanpeng; Dittrich, Thomas; Sáez-Araoz, Rodrigo; Schmid, Martina; Hinrichs, Volker; Lux-Steiner, Martha Ch.; Fischer, Christian-Herbert

2015-09-01

Phase transitions have been investigated for silver deposition onto In{sub 2}S{sub 3} precursor layers by spray chemical vapor deposition from a trimethylphosphine (hexafluoroacetylacetonato) silver (Ag(hfacac)(PMe{sub 3})) solution. The formation of Ag nanoparticles (Ag NPs) on top of the semiconductor layer set on concomitant with the formation of AgIn{sub 5}S{sub 8}. The increase of the diameter of Ag NPs was accompanied by the evolution of orthorhombic AgInS{sub 2}. The formation of Ag{sub 2}S at the interface between Ag NPs and the semiconductor layer was observed. Surface photovoltage spectroscopy indicated charge separation and electronic transitions in the ranges of corresponding band gaps. The phase transition approach is aimed to be applied for the formation of plasmonic nanostructures on top of extremely thin semiconducting layers. - Highlights: • Silver nanoparticles were deposited onto In{sub 2}S{sub 3} precursor layer by spray pyrolysis. • The silver nanoparticle size and density could be controlled by deposition time. • Phase transitions during deposition and material properties were investigated. • The layers still show semiconducting properties after phase transitions. • Plasmonic absorption enhancement has been demonstrated.

Magnetic transitions in the system YBa2Cu/sub 2.8/Co/sub 0.2/O/sub 6+y/

International Nuclear Information System (INIS)

Miceli, P.F.; Tarascon, J.M.; Barboux, P.; Greene, L.H.; Bagley, B.G.; Hull, G.W.; Giroud, M.; Rhyne, J.J.; Neumann, D.A.; National Institute of Standards and Technology, Gaithersburg, Maryland 20899)

1989-01-01

We have studied the oxygen dependence of the two magnetic transitions (antiferromagnetic ordering of chains and planes) in YBa 2 Cu/sub 2.8/Co/sub 0.2/O/sub 6+y/ using neutron scattering. It is found that both transition temperatures increase with decreasing oxygen concentration. At y approx. 0.37 ( equivalent to y 0 ) the two transition temperatures are equal, so that chains and planes order at a single transition temperature for y less than or equal to y/sub 0/. For y=1 the compound is superconducting at 60 K. Therefore, this system qualitatively exhibits the magnetic and superconducting properties of pure YBa 2 Cu 3 O/sub 6+y/ while providing important insight on the oxygen dependence of chain site magnetic ordering. A discussion is presented which also includes results on Ni and Al substitutions

On the origin of the double superconducting transition in overdoped YBa{sub 2}Cu{sub 3}O {sub x}

Energy Technology Data Exchange (ETDEWEB)

Lortz, R. [Department of Condensed Matter Physics, University of Geneva, 24 Quai Ernest-Ansermet, CH-1211 Geneva 4 (Switzerland)]. E-mail: Rolf.Lortz@physics.unige.ch; Tomita, T. [Department of Physics, Washington University, CB 1105, One Brookings Dr., St. Louis, MO 63130 (United States); Wang, Y. [Department of Condensed Matter Physics, University of Geneva, 24 Quai Ernest-Ansermet, CH-1211 Geneva 4 (Switzerland); Junod, A. [Department of Condensed Matter Physics, University of Geneva, 24 Quai Ernest-Ansermet, CH-1211 Geneva 4 (Switzerland); Schilling, J.S. [Department of Physics, Washington University, CB 1105, One Brookings Dr., St. Louis, MO 63130 (United States); Masui, T. [Department of Physics, Osaka University, Toyonaka, Osaka 560-0043 (Japan); Tajima, S. [Department of Physics, Osaka University, Toyonaka, Osaka 560-0043 (Japan)

2006-02-15

The superconducting transition in a single overdoped, detwinned YBa{sub 2}Cu{sub 3}O {sub x} (YBCO) crystal is studied using four different probes. Whereas the AC and DC magnetic susceptibilities find a dominant transition at 88 K with a smaller effect near 92 K, the specific heat and electrical resistivity reveal only a single transition at 88 K and 92 K, respectively. Under hydrostatic pressures to 0.60 GPa these two transitions shift in opposite directions, their separation increasing. The present experiments clearly show that the bulk transition lies at 88 K and originates from fully oxygenated YBCO; the 92 K transition likely arises from filamentary superconductivity in a minority optimally doped phase (<1%) of YBCO located at or near the crystal surface.

Behavior of the antiferromagnetic phase transition near the fermion condensation quantum phase transition in YbRh{sub 2}Si{sub 2}

Energy Technology Data Exchange (ETDEWEB)

Shaginyan, V.R., E-mail: vrshag@thd.pnpi.spb.r [Petersburg Nuclear Physics Institute, RAS, Gatchina 188300 (Russian Federation); Racah Institute of Physics, Hebrew University, Jerusalem 91904 (Israel); Amusia, M.Ya. [Racah Institute of Physics, Hebrew University, Jerusalem 91904 (Israel); Popov, K.G. [Komi Science Center, Ural Division, RAS, Syktyvkar 167982 (Russian Federation)

2010-01-11

Low-temperature specific-heat measurements on YbRh{sub 2}Si{sub 2} at the second order antiferromagnetic (AF) phase transition reveal a sharp peak at T{sub N}=72 mK. The corresponding critical exponent alpha turns out to be alpha=0.38, which differs significantly from that obtained within the framework of the fluctuation theory of second order phase transitions based on the scale invariance, where alphaapprox =0.1. We show that under the application of magnetic field the curve of the second order AF phase transitions passes into a curve of the first order ones at the tricritical point leading to a violation of the critical universality of the fluctuation theory. This change of the phase transition is generated by the fermion condensation quantum phase transition. Near the tricritical point the Landau theory of second order phase transitions is applicable and gives alphaapprox =1/2. We demonstrate that this value of alpha is in good agreement with the specific-heat measurements.

Quantum percolation transition in Eu{sub 1-x}Ca{sub x}B{sub 6}

Energy Technology Data Exchange (ETDEWEB)

Glushkov, V.V. [A.M.Prokhorov General Physics Institute of RAS, 38, Vavilov str., Moscow 119991 (Russian Federation); Moscow Institute of Physics and Technology, 9, Institutskii per., Dolgoprudny, Moscow Region 141700 (Russian Federation); Anisimov, M.A. [Moscow Institute of Physics and Technology, 9, Institutskii per., Dolgoprudny, Moscow Region 141700 (Russian Federation); Bogach, A.V.; Demishev, S.V.; Sluchanko, N.E. [A.M.Prokhorov General Physics Institute of RAS, 38, Vavilov str., Moscow 119991 (Russian Federation); Filipov, V.B.; Levchenko, A.V.; Shitsevalova, N.Yu. [Institute for Problems of Materials Science NAS, 3, Krzhyzhanovsky str., Kiev 03680 (Ukraine); Flachbart, K. [Centre of Low Temperature Physics, IEP SAS and IPS FS UPJS, Kosice SK-04001 (Slovakia); Kuznetsov, A.V. [Moscow Engineering Physics Institute, 31, Kashirskoe Shosse, Moscow 115409 (Russian Federation)

2010-03-15

The study of transport and magnetic properties performed on Eu{sub 1-x}Ca{sub x}B{sub 6} single crystals with nominal Ca content 0 {<=} x {<=} 0.4 at temperatures 1.8-300 K in magnetic fields up to 80 kOe provides the direct experimental evidence of metal-to-insulator transition (MIT) earlier proposed for the system by V. M. Pereira et al. [Phys. Rev. Lett., 93, 147202 (2004)]. A giant enhancement of magnetoresistance up to the values of ({rho}(0) - {rho}(H))/{rho}(H) {proportional_to} 7 x 10{sup 7}% was detected for x = 0.4 in the wide vicinity of the ferromagnetic insulating state. The field induced crossover from hole-like to electron-like regime of charge transport observed for the first time in the paramagnetic phase of Eu{sub 0.6}Ca{sub 0.4}B{sub 6} is discussed in terms of quantum percolation transition predicted for this low carrier density system within double exchange model. (Abstract Copyright [2010], Wiley Periodicals, Inc.)

Phase transitions in K-doped MoO{sub 2}

Energy Technology Data Exchange (ETDEWEB)

Alves, L. M. S., E-mail: leandro-fisico@hotmail.com; Lima, B. S. de; Santos, C. A. M. dos [Departamento de Engenharia de Materiais, Escola de Engenharia de Lorena-USP, Lorena, São Paulo 12602-810 (Brazil); Rebello, A.; Masunaga, S. H.; Neumeier, J. J. [Department of Physics, Montana State University, P.O. Box 173840, Bozeman, Montana 59717-3840 (United States); Leão, J. B. [NIST Center for Neutron Research, National Institute of Standards and Technology, 100 Bureau Dr. MS 6102, Gaithersburg, Maryland 20899-6102 (United States)

2014-05-28

K{sub 0.05}MoO{sub 2} has been studied by x-ray and neutron diffractometry, electrical resistivity, magnetization, heat capacity, and thermal expansion measurements. The compound displays two phase transitions, a first-order phase transition near room temperature and a second-order transition near 54 K. Below the transition at 54 K, a weak magnetic anomaly is observed and the electrical resistivity is well described by a power-law temperature dependence with exponent near 0.5. The phase transitions in the K-doped MoO{sub 2} compound have been discussed for the first time using neutron diffraction, high resolution thermal expansion, and heat capacity measurements as a function of temperature.

A neutron diffraction study of the superionic transition in (Ca sub 1 sub - sub x Y sub x)F sub 2 sub + sub x with x=0.06

CERN Document Server

Hofmann, M; Wilson, C C; McIntyre, G J

1997-01-01

We have investigated the high-temperature superionic transition of the anion-excess fluorite (Ca sub 1 sub - sub x Y sub x)F sub 2 sub + sub x with x=0.06 using both monochromatic and time-of-flight Laue single-crystal neutron diffraction. The measured Bragg intensities indicate that the cuboctahedral defect clusters found at ambient temperature start to break up into smaller fragments even below the superionic transition temperature, T sub c approx 1200 K. Information concerning the local defect configuration at T = 1173 K has been provided by modelling the measured distribution of the coherent elastic diffuse scattering within the (11-bar0) plane of reciprocal space. The high-temperature defects are of the 'Willis' type and strongly resemble the short-lived Frenkel clusters found in the pure fluorites such as CaF sub 2 above T sub c. (author)

Positron-annihilation studies of the superconductivity transition in YBa2Cu3O/sub 7-//sub x/

International Nuclear Information System (INIS)

Smedskjaer, L.C.; Veal, B.W.; Legnini, D.G.; Paulikas, A.P.; Nowicki, L.J.

1988-01-01

Positron-annihilation studies, by Doppler broadening, of the superconducting transition in YBa 2 Cu 3 O/sub 7-//sub x/(x≅0.1) have been made. Below T/sub c/ a large positive temperature dependence of the lineshape parameter is observed, while at (or near) T/sub c/ an almost discontinuous increase in the lineshape parameter takes place. The behavior below T/sub c/ may be consistent with a Bardeen-Cooper-Schrieffer-like theory if an energy band with a small dispersion crosses the Fermi level. The discontinuity is not clearly understood, but may be due to a major change in the electronic structure taking place with the onset of superconductivity

Data exploration, quality control and statistical analysis of ChIP-exo/nexus experiments.

Science.gov (United States)

Welch, Rene; Chung, Dongjun; Grass, Jeffrey; Landick, Robert; Keles, Sündüz

2017-09-06

ChIP-exo/nexus experiments rely on innovative modifications of the commonly used ChIP-seq protocol for high resolution mapping of transcription factor binding sites. Although many aspects of the ChIP-exo data analysis are similar to those of ChIP-seq, these high throughput experiments pose a number of unique quality control and analysis challenges. We develop a novel statistical quality control pipeline and accompanying R/Bioconductor package, ChIPexoQual, to enable exploration and analysis of ChIP-exo and related experiments. ChIPexoQual evaluates a number of key issues including strand imbalance, library complexity, and signal enrichment of data. Assessment of these features are facilitated through diagnostic plots and summary statistics computed over regions of the genome with varying levels of coverage. We evaluated our QC pipeline with both large collections of public ChIP-exo/nexus data and multiple, new ChIP-exo datasets from Escherichia coli. ChIPexoQual analysis of these datasets resulted in guidelines for using these QC metrics across a wide range of sequencing depths and provided further insights for modelling ChIP-exo data. © The Author(s) 2017. Published by Oxford University Press on behalf of Nucleic Acids Research.

Order-disorder transition and electrical conductivity of the brownmillerite solid-solutions system Ba sub 2 (In, M) sub 2 O sub 5 (M=Ga, Al)

CERN Document Server

Yamamura, H; Kakinuma, K; Mori, T; Haneda, H

1999-01-01

The brownmillerite solid-solution systems Ba sub 2 (In sub 1 sub - sub x M sub x) sub 2 O sub 5 (M=Ga, Al) were investigated by means of high-temperature X-ray diffraction (XRD), dilatometry, and electrical-conductivity measurements. XRD showed that the Ba sub 2 (In sub 1 sub - sub x Ga sub x) sub 2 O sub 5 system had orthorhombic symmetry in the composition range 0.0<=x<=0.2 and cubic symmetry in the range 0.3<=x. The Al system also changed to cubic symmetry from orthorhombic symmetry in the range 0.2<=x. While the orthorhombic phase showed an order-disorder transition in the electrical conductivity measurements, the transition temperature decreased with increasing the M content. The order-disorder transition temperature and the crystal-structure transition temperature were very different. Such a transition was not observed in the cubic phases, and their electrical conductivity were fairly low compared to those of the disordered cubic phase after the transition due to the heating process. These p...

EXO-ZODI MODELING FOR THE LARGE BINOCULAR TELESCOPE INTERFEROMETER

Energy Technology Data Exchange (ETDEWEB)

Kennedy, Grant M.; Wyatt, Mark C.; Panić, Olja; Shannon, Andrew [Institute of Astronomy, University of Cambridge, Madingley Road, Cambridge CB3 0HA (United Kingdom); Bailey, Vanessa; Defrère, Denis; Hinz, Philip M.; Rieke, George H.; Skemer, Andrew J.; Su, Katherine Y. L. [Steward Observatory, University of Arizona, 933 North Cherry Avenue, Tucson, AZ 85721 (United States); Bryden, Geoffrey; Mennesson, Bertrand; Morales, Farisa; Serabyn, Eugene [Jet Propulsion Laboratory, California Institute of Technology, 4800 Oak Grove Drive, Pasadena, CA 91109 (United States); Danchi, William C.; Roberge, Aki; Stapelfeldt, Karl R. [NASA Goddard Space Flight Center, Exoplanets and Stellar Astrophysics, Code 667, Greenbelt, MD 20771 (United States); Haniff, Chris [Cavendish Laboratory, University of Cambridge, JJ Thomson Avenue, Cambridge CB3 0HE (United Kingdom); Lebreton, Jérémy [Infrared Processing and Analysis Center, MS 100-22, California Institute of Technology, 770 South Wilson Avenue, Pasadena, CA 91125 (United States); Millan-Gabet, Rafael [NASA Exoplanet Science Institute, California Institute of Technology, 770 South Wilson Avenue, Pasadena, CA 91125 (United States); and others

2015-02-01

Habitable zone dust levels are a key unknown that must be understood to ensure the success of future space missions to image Earth analogs around nearby stars. Current detection limits are several orders of magnitude above the level of the solar system's zodiacal cloud, so characterization of the brightness distribution of exo-zodi down to much fainter levels is needed. To this end, the Large Binocular Telescope Interferometer (LBTI) will detect thermal emission from habitable zone exo-zodi a few times brighter than solar system levels. Here we present a modeling framework for interpreting LBTI observations, which yields dust levels from detections and upper limits that are then converted into predictions and upper limits for the scattered light surface brightness. We apply this model to the HOSTS survey sample of nearby stars; assuming a null depth uncertainty of 10{sup –4} the LBTI will be sensitive to dust a few times above the solar system level around Sun-like stars, and to even lower dust levels for more massive stars.

Theory of high-T{sub C} superconductivity: transition temperature

Energy Technology Data Exchange (ETDEWEB)

Harshman, Dale R [Physikon Research Corporation, Lynden, WA 98264 (United States); Fiory, Anthony T [Department of Physics, New Jersey Institute of Technology, Newark, NJ 07102 (United States); Dow, John D, E-mail: drh@physikon.net [Department of Physics, Arizona State University, Tempe, AZ 85287 (United States)

2011-07-27

It is demonstrated that the transition temperature (T{sub C}) of high-T{sub C} superconductors is determined by their layered crystal structure, bond lengths, valency properties of the ions, and Coulomb coupling between electronic bands in adjacent, spatially separated layers. Analysis of 31 high-T{sub C} materials (cuprates, ruthenates, ruthenocuprates, iron pnictides, organics) yields the universal relationship for optimal compounds, k{sub B}T{sub C0} ={beta}/{iota}{zeta}, where {iota} is related to the mean spacing between interacting charges in the layers, {zeta} is the distance between interacting electronic layers, {beta} is a universal constant and T{sub C0} is the optimal transition temperature (determined to within an uncertainty of {+-} 1.4 K by this relationship). Non-optimum compounds, in which sample degradation is evident, e.g. by broadened superconducting transitions and diminished Meissner fractions, typically exhibit reduced T{sub C} < T{sub C0}. It is shown that T{sub C0} may be obtained from an average of the Coulomb interaction forces between the two layers.

Open volume defects and magnetic phase transition in Fe{sub 60}Al{sub 40} transition metal aluminide

Energy Technology Data Exchange (ETDEWEB)

Liedke, M. O., E-mail: m.liedke@hzdr.de; Anwand, W.; Butterling, M.; Wagner, A. [Institute of Radiation Physics, Helmholtz-Zentrum Dresden - Rossendorf, Bautzner Landstraße 400, 01328 Dresden (Germany); Bali, R.; Cornelius, S.; Potzger, K. [Institute of Ion Beam Physics and Materials Research, Helmholtz-Zentrum Dresden - Rossendorf, Bautzner Landstraße 400, 01328 Dresden (Germany); Trinh, T. T. [Institute of Radiation Physics, Helmholtz-Zentrum Dresden - Rossendorf, Bautzner Landstraße 400, 01328 Dresden (Germany); Technical University Dresden, Helmholtzstr. 10, 01609 Dresden (Germany); Salamon, S.; Walecki, D.; Smekhova, A.; Wende, H. [Faculty of Physics and Center for Nanointegration Duisburg-Essen (CENIDE), University of Duisburg-Essen, Lotharstraße 1, 47048 Duisburg (Germany)

2015-04-28

Magnetic phase transition in the Fe{sub 60}Al{sub 40} transition metal aluminide from the ferromagnetic disordered A2-phase to the paramagnetic ordered B2-phase as a function of annealing up to 1000 °C has been investigated by means of magneto-optical and spectroscopy techniques, i.e., Kerr effect, positron annihilation, and Mössbauer spectroscopy. The positron annihilation spectroscopy has been performed in-situ sequentially after each annealing step at the Apparatus for In-situ Defect Analysis that is a unique tool combining positron annihilation spectroscopy with temperature treatment, material evaporation, ion irradiation, and sheet resistance measurement techniques. The overall goal was to investigate the importance of the open volume defects onto the magnetic phase transition. No evidence of variation in the vacancy concentration in matching the magnetic phase transition temperature range (400–600 °C) has been found, whereas higher temperatures showed an increase in the vacancy concentration.

EXO-DAT: AN INFORMATION SYSTEM IN SUPPORT OF THE CoRoT/EXOPLANET SCIENCE

International Nuclear Information System (INIS)

Deleuil, M.; Meunier, J. C.; Moutou, C.; Surace, C.; Barbieri, M.; Agneray, F.; Granet, Y.; Guterman, P.; Deeg, H. J.; Almenara, J. M.; Debosscher, J.; Hodgkin, S.

2009-01-01

Exo-Dat is a database and an information system created primarily in support of the exoplanet program of the COnvection ROtation and planetary Transits (CoRoT) mission. In the directions of CoRoT pointings, it provides a united interface to several sets of data: stellar published catalogs, photometric and spectroscopic data obtained during the mission preparation, results from the mission and from follow-up observations, and several mission-specific technical parameters. The new photometric data constitute the subcatalog Exo-Cat, and give consistent 4-color photometry of 14.0 million stars with a completeness to 19th magnitude in the r-filter. It covers several zones in the galactic plane around CoRoT pointings, with a total area of 209 deg 2 . This Exo-Dat information system provides essential technical support to the ongoing CoRoT light-curve analyses and ground-based follow-up by supplying additional complementary information such as the prior knowledge of the star's fundamental parameters or its contamination level inside the large CoRoT photometric mask. The database is fully interfaced with VO tools and thus benefits from existing visualization and analysis tools like TOPCAT or ALADIN. It is accessible to the CoRoT community through the Web, and will be gradually opened to the public. It is the ideal tool to prepare the foreseen statistical studies of the properties of the exoplanetary systems. As a VO-compliant system, such analyses could thus benefit from the most up-to-date classifier tools.

Energetic transition in the electric sector: Brazilian case

International Nuclear Information System (INIS)

Jannuzzi, Gilberto de Martino

1999-01-01

The Brazilian electric sector is essentially based on a source of renewable energy -hydroelectricity, and the national economy has increased its dependence of the electricity. The use of the electricity for unit of GDP increased in continuous form from 1970 and the country has serious difficulties in the financing of the expansion of the electric production. Energetic politics, in what concerns to the sustainable development in the Brazilian case, should direct its efforts toward a bigger investment in efficiency and energy conservation. a bigger use of supply options that they are renewable and decentralized will depend on high degree of the regulation of the electric sector during the privatization. The transition stage of the Brazilian electric sector will imply more efforts toward a handling based on the demand and a bigger efficiency

Exo-oligosaccharides of Rhizobium sp. strain NGR234 are required for symbiosis with various legumes.

Science.gov (United States)

Staehelin, Christian; Forsberg, Lennart S; D'Haeze, Wim; Gao, Mu-Yun; Carlson, Russell W; Xie, Zhi-Ping; Pellock, Brett J; Jones, Kathryn M; Walker, Graham C; Streit, Wolfgang R; Broughton, William J

2006-09-01

Rhizobia are nitrogen-fixing bacteria that establish endosymbiotic associations with legumes. Nodule formation depends on various bacterial carbohydrates, including lipopolysaccharides, K-antigens, and exopolysaccharides (EPS). An acidic EPS from Rhizobium sp. strain NGR234 consists of glucosyl (Glc), galactosyl (Gal), glucuronosyl (GlcA), and 4,6-pyruvylated galactosyl (PvGal) residues with beta-1,3, beta-1,4, beta-1,6, alpha-1,3, and alpha-1,4 glycoside linkages. Here we examined the role of NGR234 genes in the synthesis of EPS. Deletions within the exoF, exoL, exoP, exoQ, and exoY genes suppressed accumulation of EPS in bacterial supernatants, a finding that was confirmed by chemical analyses. The data suggest that the repeating subunits of EPS are assembled by an ExoQ/ExoP/ExoF-dependent mechanism, which is related to the Wzy polymerization system of group 1 capsular polysaccharides in Escherichia coli. Mutation of exoK (NGROmegaexoK), which encodes a putative glycanase, resulted in the absence of low-molecular-weight forms of EPS. Analysis of the extracellular carbohydrates revealed that NGROmegaexoK is unable to accumulate exo-oligosaccharides (EOSs), which are O-acetylated nonasaccharide subunits of EPS having the formula Gal(Glc)5(GlcA)2PvGal. When used as inoculants, both the exo-deficient mutants and NGROmegaexoK were unable to form nitrogen-fixing nodules on some hosts (e.g., Albizia lebbeck and Leucaena leucocephala), but they were able to form nitrogen-fixing nodules on other hosts (e.g., Vigna unguiculata). EOSs of the parent strain were biologically active at very low levels (yield in culture supernatants, approximately 50 microg per liter). Thus, NGR234 produces symbiotically active EOSs by enzymatic degradation of EPS, using the extracellular endo-beta-1,4-glycanase encoded by exoK (glycoside hydrolase family 16). We propose that the derived EOSs (and not EPS) are bacterial components that play a crucial role in nodule formation in various legumes.

Pressure-induced Td to 1T' structural phase transition in WTe<sub>2sub>

Energy Technology Data Exchange (ETDEWEB)

Zhou, Yonghui; Chen, Xuliang; Li, Nana; Zhang, Ranran; Wang, Xuefei; An, Chao; Zhou, Ying; Pan, Xingchen; Song, Fengqi; Wang, Baigeng; Yang, Wenge; Yang, Zhaorong; Zhang, Yuheng (CIW); (Chinese Aca. Sci.); (CHPSTAR- China); (Nanjing)

2016-11-21

WTe<sub>2sub> is provoking immense interest owing to its extraordinary properties, such as large positive magnetoresistance, pressure-driven superconductivity and possible type-II Weyl semimetal state. Here we report results of high-pressure synchrotron X-ray diffraction (XRD), Raman and electrical transport measurements on WTe<sub>2sub>. Both the XRD and Raman results reveal a structural transition upon compression, starting at 6.0 GPa and completing above 15.5 GPa. We have determined that the high-pressure lattice symmetry is monoclinic 1T' with space group of P21/m. This transition is related to a lateral sliding of adjacent Te-W-Te layers and results in a collapse of the unit cell volume by ~20.5%. The structural transition also casts a pressure range with the broadened superconducting transition, where the zero resistance disappears.

The Hagedorn spectrum, nuclear level densities and first order phase transitions

Energy Technology Data Exchange (ETDEWEB)

Moretto, Luciano G., E-mail: lgmoretto@lbl.gov [Department of Chemistry, University of California, Berkeley, Lawrence Berkeley National Laboratory 1 Cyclotron Road, Berkeley, CA 94720 (United States); Larsen, A. C.; Guttormsen, M.; Siem, S. [Department of Physics, University of Oslo, N-0316 Oslo (Norway)

2015-10-15

An exponential mass spectrum, like the Hagedorn spectrum, with slope 1/T{sub H} was interpreted as fixing an upper limiting temperature T{sub H} that the system can achieve. However, thermodynamically, such spectrum indicates a 1{sup st} order phase transition at a fixed temperature T{sub H}. A much lower energy example is the log linear level nuclear density below the neutron binding energy that prevails throughout the nuclear chart. We show that, for non-magic nuclei, such linearity implies a 1{sup st} order phase transition from the pairing superfluid to an ideal gas of quasi particles.

An investigation on phase transition behaviors in MgO-doped Pb{sub 0.99}(Zr{sub 0.95}Ti{sub 0.05}){sub 0.98}Nb{sub 0.02}O{sub 3} ferroelectric ceramics by Raman and dielectric measurements

Energy Technology Data Exchange (ETDEWEB)

Wang, Junxia, E-mail: wjunxia2002@163.com [Key Laboratory of Inorganic Functional Materials and Devices, Shanghai Institute of Ceramics, Chinese Academy of Sciences, Shanghai 200050 (China); State Key Laboratory Cultivation Base for Nonmetal Composites and Functional Materials, Southwest University of Science and Technology, Mianyang 621010 (China); Wang, Genshui; Chen, Xuefeng [Key Laboratory of Inorganic Functional Materials and Devices, Shanghai Institute of Ceramics, Chinese Academy of Sciences, Shanghai 200050 (China); Hu, Zhigao [Key Laboratory of Polar Materials and Devices, Ministry of Education, Department of Electronic Engineering, East China Normal University, Shanghai 200241 (China); Nie, Hengchang; Cao, Fei [Key Laboratory of Inorganic Functional Materials and Devices, Shanghai Institute of Ceramics, Chinese Academy of Sciences, Shanghai 200050 (China); Dong, Xianlin, E-mail: xldong@mail.sic.ac.cn [Key Laboratory of Inorganic Functional Materials and Devices, Shanghai Institute of Ceramics, Chinese Academy of Sciences, Shanghai 200050 (China)

2015-03-15

Highlights: • The phase transition behaviors were strongly dependent on MgO concentration. • The F{sub R(LT)}–F{sub R(HT)} phase transition temperature obviously shifted toward a lower temperature with increasing MgO addition. • The F{sub R(HT)}–cubic paraelectric (P{sub C}) phase transition changed to a higher temperature with increasing MgO addition. • The distortion of BO{sub 6} oxygen octahedron caused by B-site replacement of Mg{sup 2+} ions is proposed to explain the observed behaviors. • Superior room-temperature pyroelectric properties were obtained in 0.1 wt% MgO-modified PZTN 95/5 ceramics during F{sub R(LT)}–F{sub R(HT)} phase transition. - Abstract: The phase transition behaviors of Pb{sub 0.99}(Zr{sub 0.95}Ti{sub 0.05}){sub 0.98}Nb{sub 0.02}O{sub 3} ferroelectric ceramics doped with different MgO concentrations (0–0.2 wt%) were systematically investigated by Raman and dielectric measurements. Raman results showed that the phase transitions were strongly dependent on MgO concentration. It was found that the low temperature rhombohedral (F{sub R(LT)})–high temperature rhombohedral (F{sub R(HT)}) ferroelectric phase transition shifted toward a lower temperature with increasing MgO concentration up to 0.1 wt%, while the F{sub R(HT)}–cubic paraelectric (P{sub C}) phase transition changed to a higher temperature. The Raman results were in good agreement with phase transition determined by dielectric measurements. Moreover, it was indicated that the changes of Raman active modes were related to distortion of BO{sub 6} octahedra during the phase transitions. Then, the distortion of BO{sub 6} octahedron caused by B-site replacement of Mg{sup 2+} ions was proposed to explain the observed behaviors. In addition, the effects of MgO doping on the dielectric, ferroelectric and pyroelectric properties were also discussed.

Anomalous second ferromagnetic phase transition in Co{sub 0.08}Bi{sub 1.92}Se{sub 3} topological insulator

Energy Technology Data Exchange (ETDEWEB)

Zhang, Min, E-mail: zmzmi1987@163.com; Liu, Ligang; Yang, Hui

2016-09-05

We report the observation of ferromagnetism in topological insulator Co{sub 0.08}Bi{sub 1.92}Se{sub 3} single crystal. The structural, magnetic, and microstructure properties of Co{sub 0.08}Bi{sub 1.92}Se{sub 3} are investigated. The existence of complicated ferromagnetic ordering, indicates the anomalous second ferromagnetic phase transition below 30 K. Well-defined ferromagnetic hysteresis in the magnetization was found in the sample. The origin of bulk ferromagnetism in Co{sub 0.08}Bi{sub 1.92}Se{sub 3} is concerned with three aspects: Co cluster, RKKY interactions, and the spin texture of Co impurities. - Highlights: • The bulk ferromagnetism have been found in the C{sub o0.08}Bi{sub 1.92}Se{sub 3} single crystal. • The anomalous second ferromagnetic phase transition is found below 30 K. • The origin of bulk ferromagnetism in Co{sub 0.08}Bi{sub 1.92}Se{sub 3} is concerned with three aspects.

Oxygen vacancies dependent phase transition of Y{sub 2}O{sub 3} films

Energy Technology Data Exchange (ETDEWEB)

Yu, Pengfei; Zhang, Kan [Department of Materials Science, State Key Laboratory of Superhard Materials, and Key Laboratory of Automobile Materials, MOE, Jilin University, Changchun 130012 (China); Huang, Hao [Titanium Alloys Lab. Beijing Institute of Aeronautical Materials, Beijing 81-15 100095 (China); Wen, Mao, E-mail: Wenmao225@jlu.edu.cn [Department of Materials Science, State Key Laboratory of Superhard Materials, and Key Laboratory of Automobile Materials, MOE, Jilin University, Changchun 130012 (China); Li, Quan; Zhang, Wei; Hu, Chaoquan [Department of Materials Science, State Key Laboratory of Superhard Materials, and Key Laboratory of Automobile Materials, MOE, Jilin University, Changchun 130012 (China); Zheng, Weitao, E-mail: WTZheng@jlu.edu.cn [Department of Materials Science, State Key Laboratory of Automotive Simulation and Control and Key Laboratory of Automobile Materials, MOE, Jilin University, Changchun 130012 (China)

2017-07-15

Highlights: • Oxygen vacancies for Y{sub 2}O{sub 3} films increase monotonously with increasing T{sub s}. • Oxygen vacancies can promote the nucleation of monoclinic phase. • That monoclinic phase with oxygen deficiency is not thermodynamic stable at high temperature. • Phase transition from monoclinic to oxygen defective occurs at high concentrations of oxygen vacancies. • High hardness just appears in Y{sub 2}O{sub 3} films with mixed phase configurations. - Abstract: Y{sub 2}O{sub 3} films have great application potential in high-temperature metal matrix composite and nuclear engineering, used as interface diffusion and reaction barrier coating owing to their excellent thermal and chemical stability, high melting point and extremely negative Gibbs formation energy, and thus their structural and mechanical properties at elevated temperature are especially important. Oxygen vacancies exist commonly in yttrium oxide (Y{sub 2}O{sub 3}) thin films and act strongly on the phase structure and properties, but oxygen vacancies dependent phase transition at elevated temperature has not been well explored yet. Y{sub 2}O{sub 3} thin films with different oxygen vacancy concentrations have been achieved by reactive sputtering through varying substrate temperature (T{sub s}), in which oxygen vacancies increase monotonously with increasing T{sub s}. For as-deposited Y{sub 2}O{sub 3} films, oxygen vacancies present at high T{sub s} can promote the nucleation of monoclinic phase, meanwhile, high T{sub s} can induce the instability of monoclinic phase. Thus their competition results in forming mixed phases of cubic and monoclinic at high T{sub s}. During vacuum annealing at 1000 °C, a critical oxygen vacancy concentration is observed, below which phase transition from monoclinic to cubic takes place, and above which phase transfer from monoclinic to the oxygen defective phase (ICDD file no. 39-1063), accompanying by stress reversal from compressive to tensile and

The La(Fe,Mn,Si){sub 13}H{sub z} magnetic phase transition under pressure

Energy Technology Data Exchange (ETDEWEB)

Lovell, Edmund; Boldrin, David C.; Cohen, Lesley F. [Department of Physics, Blackett Laboratory, Imperial College London (United Kingdom); Bez, Henrique N. [The Ames Laboratory of the US DOE, Iowa State University, Ames, IA (United States); Nielsen, Kaspar K.; Smith, Anders; Bahl, Christian R.H. [Department of Energy Conversion and Storage, Technical University of Denmark, Roskilde (Denmark)

2017-08-15

We study the magnetocaloric metamagnetic transition in LaFe{sub 11.74}Mn{sub 0.06}Si{sub 1.20} and LaFe{sub 11.76}Mn{sub 0.06}Si{sub 1.18}H{sub 1.65} under hydrostatic pressure up to 1.2 GPa. For both compounds, hydrostatic pressure depresses the zero field critical temperature. However, in detail, pressure influences the magnetic properties in different ways in the two compounds. In the dehydrogenated case the transition broadens under pressure whereas in the hydrogenated case the transition sharpens. In both cases thermal hysteresis increases under pressure, although with different trends. These observations suggest both intrinsic and extrinsic hysteresis loss brought about by the use of hydrostatic pressure. We explore the multicaloric field-pressure cycle, demonstrating that although the gain introduced by overcoming the magnetic hysteresis loss is closely countered by the loss introduced in the pressure cycle, there are significant advantages in that the temperature range of operation can be finely tuned and extended, and the magnetocaloric transition can operate in lower absolute applied fields (<0.5 T), potentially overcoming one of the most significant bottlenecks to the commercialization of this technology. (copyright 2017 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

The Impact of ExoS on Pseudomonas aeruginosa Internalization by Epithelial Cells Is Independent of fleQ and Correlates with Bistability of Type Three Secretion System Gene Expression.

Science.gov (United States)

Kroken, Abby R; Chen, Camille K; Evans, David J; Yahr, Timothy L; Fleiszig, Suzanne M J

2018-05-01

Pseudomonas aeruginosa is internalized into multiple types of epithelial cell in vitro and in vivo and yet is often regarded as an exclusively extracellular pathogen. Paradoxically, ExoS, a type three secretion system (T3SS) effector, has antiphagocytic activities but is required for intracellular survival of P. aeruginosa and its occupation of bleb niches in epithelial cells. Here, we addressed mechanisms for this dichotomy using invasive (ExoS-expressing) P. aeruginosa and corresponding effector-null isogenic T3SS mutants, effector-null mutants of cytotoxic P. aeruginosa with and without ExoS transformation, antibiotic exclusion assays, and imaging using a T3SS-GFP reporter. Except for effector-null PA103, all strains were internalized while encoding ExoS. Intracellular bacteria showed T3SS activation that continued in replicating daughter cells. Correcting the fleQ mutation in effector-null PA103 promoted internalization by >10-fold with or without ExoS. Conversely, mutating fleQ in PAO1 reduced internalization by >10-fold, also with or without ExoS. Effector-null PA103 remained less well internalized than PAO1 matched for fleQ status, but only with ExoS expression, suggesting additional differences between these strains. Quantifying T3SS activation using GFP fluorescence and quantitative reverse transcription-PCR (qRT-PCR) showed that T3SS expression was hyperinducible for strain PA103Δ exoUT versus other isolates and was unrelated to fleQ status. These findings support the principle that P. aeruginosa is not exclusively an extracellular pathogen, with internalization influenced by the relative proportions of T3SS-positive and T3SS-negative bacteria in the population during host cell interaction. These data also challenge current thinking about T3SS effector delivery into host cells and suggest that T3SS bistability is an important consideration in studying P. aeruginosa pathogenesis. IMPORTANCE P. aeruginosa is often referred to as an extracellular

Detection of oxygen-related defects in GaAs by exo-electron emission spectroscopy

Energy Technology Data Exchange (ETDEWEB)

Hulluvarad, Shiva S.; Naddaf, M.; Bhoraskar, S.V. E-mail: svb@physics.unipune.ernet.in

2001-10-01

The influence of intentional introduction of oxygen, at the surface of GaAs, on its native surface states was studied. Oxygen was made to interact with the surface of GaAs by three different means: (1) by growing native oxides, (2) exposing to oxygen plasma in an electron cyclotron resonance (ECR) plasma reactor and by (3) high energy oxygen ion irradiation. Thermally stimulated exo-electron emission (TSEE) spectroscopy was used to estimate the relative densities and energies of the surface states induced by the three different modes of introducing oxygen. Out of the two native defect levels found in GaAs by TSEE; at 325 K (0.7 eV below E{sub c}) and at 415 K (0.9 below E{sub c}); the former is seen to get broadened or split into multiple peaks in each of the methods. Multiple peaks in TSEE signify the presence of a closely spaced band of defect levels. Therefore the results exclusively point out that oxygen-related complexes contribute to the formation of a band of defects centered at 325 K in TSEE which is correlated to an energy level 0.7 eV below E{sub c} known as the EL2 defect level. The results reported in this paper thus confirm that the TSEE peak at 0.7 eV below E{sub c} is related to oxygen induced defects whereas the peak at 0.9 eV is not affected by the presence of oxygen-related species.

Judd–Ofelt analysis and transition probabilities of Er{sup 3+} doped KY{sub 1−x−y}Gd{sub x}Lu{sub y}(WO{sub 4}){sub 2} crystals

Energy Technology Data Exchange (ETDEWEB)

Martínez de Mendívil, Jon, E-mail: jon.martinez@uam.es [Departamento de Física de Materiales, Universidad Autónoma de Madrid, 28049 Madrid (Spain); Lifante, Ginés [Departamento de Física de Materiales, Universidad Autónoma de Madrid, 28049 Madrid (Spain); Pujol, Maria Cinta; Aguiló, Magdalena; Díaz, Francesc [Física i Cristalografia de Materials i Nanomaterials (FiCMA-FiCNA), Universitat Rovira i Virgili, Tarragona (Spain); Cantelar, Eugenio [Departamento de Física de Materiales, Universidad Autónoma de Madrid, 28049 Madrid (Spain)

2015-09-15

In this work the transition probabilities, radiative lifetimes and branching ratios of Er{sup 3+} ions in KY{sub 1−x−y}Gd{sub x}Lu{sub y}(WO{sub 4}){sub 2} crystals have been determined. With this aim, Er{sup 3+} doped KY{sub 1−x−y}Gd{sub x}Lu{sub y}(WO{sub 4}){sub 2} crystals have been grown by means of the high temperature Top-Seeded Solution Growth. A spectroscopic analysis of Er{sup 3+} ions in this crystal has been performed following anisotropic Judd–Ofelt analysis to obtain basic spectroscopic properties. A quantum efficiency over 97% has been determined for the {sup 4}I{sub 13/2}→{sup 4}I{sub 15/2} transition, indicating that this material is adequate for the development of lasers and amplifiers working in the third telecommunication window. - Highlights: • Er{sub 0.01}:KY{sub 1−x−y}Gd{sub x}Lu{sub y}(WO{sub 4}){sub 2} crystals have been grown. • Anisotropic Judd Ofelt analysis has been carried out. • Optical transition probabilities and branching ratios have been calculated. • Radiative and non-radiative lifetimes have been obtained.

Transiting exoplanets from the CoRoT space mission. IV. CoRoT-Exo-4b: a transiting planet in a 9.2 day synchronous orbit

Science.gov (United States)

Aigrain, S.; Collier Cameron, A.; Ollivier, M.; Pont, F.; Jorda, L.; Almenara, J. M.; Alonso, R.; Barge, P.; Bordé, P.; Bouchy, F.; Deeg, H.; de La Reza, R.; Deleuil, M.; Dvorak, R.; Erikson, A.; Fridlund, M.; Gondoin, P.; Gillon, M.; Guillot, T.; Hatzes, A.; Lammer, H.; Lanza, A. F.; Léger, A.; Llebaria, A.; Magain, P.; Mazeh, T.; Moutou, C.; Paetzold, M.; Pinte, C.; Queloz, D.; Rauer, H.; Rouan, D.; Schneider, J.; Wuchter, G.; Zucker, S.

2008-09-01

CoRoT, the first space-based transit search, provides ultra-high-precision light curves with continuous time-sampling over periods of up to 5 months. This allows the detection of transiting planets with relatively long periods, and the simultaneous study of the host star's photometric variability. In this Letter, we report the discovery of the transiting giant planet CoRoT-Exo-4b and use the CoRoT light curve to perform a detailed analysis of the transit and determine the stellar rotation period. The CoRoT light curve was pre-processed to remove outliers and correct for orbital residuals and artefacts due to hot pixels on the detector. After removing stellar variability about each transit, the transit light curve was analysed to determine the transit parameters. A discrete autocorrelation function method was used to derive the rotation period of the star from the out-of-transit light curve. We determine the periods of the planetary orbit and star's rotation of 9.20205 ± 0.00037 and 8.87 ± 1.12 days respectively, which is consistent with this being a synchronised system. We also derive the inclination, i = 90.00_-0.085+0.000 in degrees, the ratio of the orbital distance to the stellar radius, a/Rs = 17.36-0.25+0.05, and the planet-to-star radius ratio R_p/R_s=0.1047-0.0022+0.0041. We discuss briefly the coincidence between the orbital period of the planet and the stellar rotation period and its possible implications for the system's migration and star-planet interaction history. The CoRoT space mission, launched on December 27th 2006, has been developed and is operated by CNES, with the contribution of Austria, Belgium, Brazil, ESA, Germany, and Spain. The first CoRoT data will be available to the public in February 2009 from the CoRoT archive: http://idoc-corot.ias.u-psud.fr/ Figures 1, 4 and 5 are only available in electronic form at http://www.aanda.org

Raman spectroscopy, dielectric properties and phase transitions of Ag{sub 0.96}Li{sub 0.04}NbO{sub 3} ceramics

Energy Technology Data Exchange (ETDEWEB)

Niewiadomski, Adrian, E-mail: aniewiadomski@us.edu.pl [A. Chelkowski Institute of Physics, University of Silesia, Uniwersytecka 4, 40-007 Katowice (Poland); Kania, Antoni [A. Chelkowski Institute of Physics, University of Silesia, Uniwersytecka 4, 40-007 Katowice (Poland); Kugel, Godefroy E. [LMPOS, University of Metz and Supelec Metz, 2 rue E. Belin, Metz 57070 (France); Hafid, Mustapha [LPGC Dept. of Physics BP 133, Faculty of Science, Ibn Tofail University, 14000 Kenitra (Morocco); Sitko, Dorota [Institute of Physics, Pedagogical University, ul. Podchorazych 2, PL 30-084 Krakow (Poland)

2015-05-15

Highlights: • First Raman scattering studies of Ag{sub 0.96}Li{sub 0.04}NbO{sub 3}, allowed us to correlate temperature evolution of relaxational frequency γ{sub R}(T) with the Nb-ion dynamics and showed its changes at freezing temperature and ferrielectric transition. - Abstract: Silver lithium niobates Ag{sub 1−x}Li{sub x}NbO{sub 3} are promising lead free piezoelectrics. Good quality Ag{sub 0.96}Li{sub 0.04}NbO{sub 3} ceramics were obtained. Dielectric and DSC studies showed that, in comparison to AgNbO{sub 3,} temperatures of phase transitions slightly decrease. Dielectric studies pointed to enhancement of polar properties. Remnant polarisations achieves value of 0.6 μC/cm{sup 2}. Maximum of ϵ(T) dependences related to the relaxor-like ferroelectric/ferrielectric M{sub 1}–M{sub 2} transition becomes higher and more frequency dependent. Analysis of Raman spectra showed that two modes at 50 and 194 cm{sup −1} exhibit significant softening. Low frequency part of the Raman spectra which involve central peak and soft mode were analysed using two models. CP was assumed as relaxational vibration and described by Debye function. The slope of temperature dependences of relaxational frequency γ{sub R}(T) changes at approximately 470 and 330 K, indicating that slowing down process of relaxational vibrations changes in the vicinity of partial freezing of Nb-ion dynamics T{sub f} and further freezing at ferroelectric/ferrielectric phase transition.

Pressure induced insulator–metal transition and giant negative piezoresistance in Pr{sub 0.6}Ca{sub 0.4}Mn{sub 0.96}Al{sub 0.04}O{sub 3} polycrystal

Energy Technology Data Exchange (ETDEWEB)

Arumugam, S., E-mail: sarumugam1963@yahoo.com [Centre for High Pressure Research, School of Physics, Bharathidasan University, Tiruchirapalli 620024, Tamil Nadu (India); Thiyagarajan, R. [Center for High Pressure Science and Technology Advanced Research (HPSTAR), Shanghai 201203 (China); Kalaiselvan, G.; Sivaprakash, P. [Centre for High Pressure Research, School of Physics, Bharathidasan University, Tiruchirapalli 620024, Tamil Nadu (India)

2016-11-01

The effect of external hydrostatic pressure (P) on the magnetization (M) and resistivity (ρ) properties of charge-orbital (CO) ordered-insulating phase-separated manganite Pr{sub 0.6}Ca{sub 0.4}Mn{sub 0.96}Al{sub 0.04}O{sub 3} system is reported here. At ambient P, CO ordering transition and spin-canting in the AFM are observed at 223 K and 55 K respectively in M(T) and ρ(T) measurements. Application of P increases simultaneously the magnitude of magnetization (M) and transition temperature, and weakens the CO ordering in M(T) measurements up to 0.98 GPa. During ρ(T) measurements, P induces an insulator–metallic transition (T{sub IM}) at 1.02 GPa, and further increase of P up to 2.84 GPa leads to increase of T{sub IM} (dT{sub IM}/dP =21.6 K/GPa). ρ at T{sub IM} is reduced about three orders of magnitude at 2.84 GPa, and leads to the giant negative piezoresistance (~98%). These results are analyzed separately in two temperature regions i.e., below and above T{sub IM} by power function equation and small polaronic hopping model respectively. It is understood from these analyses that the application of P suppresses the Jahn–Teller distortions, electron–electron and electron–magnon scattering factors, and induces the insulator–metal transition in Pr{sub 0.6}Ca{sub 0.4}Mn{sub 0.96}Al{sub 0.04}O{sub 3} system. - Highlights: • Application of P on Pr{sub 0.6}Ca{sub 0.4}Mn{sub 0.96}Al{sub 0.04}O{sub 3} reduces resistivity (ρ) remarkably at low-temperatures, and exhibits an insulator to metallic transition at 1.02 GPa. • The reduction in ρ by P is about three orders of magnitude at 2.84 GPa, leads to the giant negative piezoresistance about 98%. • The effect of the suppression of Jahn–Teller distortions, electron–electron and electron–magnon scattering under an applied P exhibits to the metal-Insulator transition. • The phase-separation in this system has been tuned by both internal and external perturbations.

Optimization of energy and fluence of N{sub 2}{sup +} ions in the conversion of Al{sub 2}O{sub 3} surface into AlN at room temperature

Energy Technology Data Exchange (ETDEWEB)

Kumar, Praveen, E-mail: praiitr@gmail.com [Center for Nanoscience and Nanotechnology, Panjab University, Chandigarh 160014 (India); Devi, Pooja [Central Scientific Instruments Organization, Sector-30 C, Chandigarh 160030 (India); Kumar, Mahesh [Physics of Energy and Harvesting group, National Physical Laboratory, New Delhi 110012 (India); Shivaprasad, S.M. [Jawaharlal Nehru Centre for Advanced Scientific Research, Bangalore 560064 (India)

2016-01-15

Graphical abstract: We present a systematic study of energetic N{sub 2}{sup +} ions (0.1–5 keV) interaction with clean c-plane Al{sub 2}O{sub 3} surface in situ in a UHV system equipped with X-ray Photoelectron Spectroscopy at room temperature. Results show that maximum thickness of surface is nitride by 5 keV N{sub 2}{sup +} ion with an optimal fluence of 1.5 × 10{sup 15} ions/cm{sup 2}. This modified surface can be used as a template for low defect III-nitrides growth, with enhanced lattice matching than on bare c-Al{sub 2}O{sub 3}. - Highlights: • A mechanism for the formation of AlN on Al{sub 2}O{sub 3}. • Investigation of optimal energy and fluence for energetic N{sub 2}{sup +} ions. • AlN formation at room temperature on Al{sub 2}O{sub 3}. - Abstract: The work presents a systematic study of energetic N{sub 2}{sup +} ion interaction with the clean Al{sub 2}O{sub 3} surface at room temperature. Energetic N{sub 2}{sup +} ions with energies ranging from 0.1 to 5 keV were bombarded onto the c-plane Al{sub 2}O{sub 3} surface in situ in a UHV system equipped with X-ray Photoelectron Spectroscopy. Survey scans and core level spectra of Al(2p), O(1s), N(1s) were recorded as a function of ion fluence. Survey scans of XPS are used for the compositional analysis, while deconvoluted core level spectra are used to identify the evolution of the chemical bonding. Energetic dependence of N{sub 2}{sup +} ions occupying interstitial and substitutional sites in Al{sub 2}O{sub 3} lattice are probed to follow the surface evolution. Results show that maximum thickness of surface is nitride by 5 keV N{sub 2}{sup +} ion with an optimal fluence of 1.5 × 10{sup 15} ions/cm{sup 2}. This modified surface can be used as a template for low defect III-nitrides growth, with enhanced lattice matching than on bare c-Al{sub 2}O{sub 3}.

Martensitic transition, inverse magnetocaloric effect and shape memory characteristics in Mn{sub 48−x}Cu{sub x}Ni{sub 42}Sn{sub 10} Heusler alloys

Energy Technology Data Exchange (ETDEWEB)

Liu, Changqin [Department of Physics, Shanghai University, Shanghai 200444 (China); Li, Zhe [Reasearch center for magnetic materials and devices & Key Laboratory for Advanced Functional and Low Dimensional Materials of Yunnan Higher Education Institute, Qujing Normal University, Qujing 655011 (China); Zhang, Yuanlei [Department of Physics, Shanghai University, Shanghai 200444 (China); Reasearch center for magnetic materials and devices & Key Laboratory for Advanced Functional and Low Dimensional Materials of Yunnan Higher Education Institute, Qujing Normal University, Qujing 655011 (China); Liu, Yang; Sun, Junkun; Huang, Yinsheng; Kang, Baojuan [Department of Physics, Shanghai University, Shanghai 200444 (China); Xu, Kun [Reasearch center for magnetic materials and devices & Key Laboratory for Advanced Functional and Low Dimensional Materials of Yunnan Higher Education Institute, Qujing Normal University, Qujing 655011 (China); Deng, Dongmei [Department of Physics, Shanghai University, Shanghai 200444 (China); Jing, Chao, E-mail: cjing@staff.shu.edu.cn [Department of Physics, Shanghai University, Shanghai 200444 (China)

2017-03-01

In this paper, we have systematically prepared a serials of polycrystalline Mn{sub 48−x}Cu{sub x}Ni{sub 42}Sn{sub 10} alloys (x=0, 1, 3, 5, 6, 8, 10 and 12) and investigated the influence of the Cu doping on martensitic transition (MT) as well as magnetic properties. Experimental results indicate that the MT temperature and the martensite Curie temperature (T{sub c}{sup M}) shift to high temperature with increasing the substitution of Cu (from Mn rich alloy to Ni rich alloy), while the austenite Curie temperature (T{sub c}{sup A}) is almost unchanged. It was found that the structures undergo L2{sub 1} and 4O with the increasing of Cu concentration near room temperature. Therefore, the magnetostructural transition can be tuned by appropriate Cu doping in these alloys. Moreover, we mainly studied the multiple functional properties for inverse magnetocaloric effect and shape memory characteristics associated with the martensitic transition. A large positive isothermal entropy change of Mn{sub 48}Ni{sub 42}Sn{sub 10} was obtained, and the maximum transition entropy change achieves about 48 J/kg K as x=8. In addition, a considerable temperature-induced spontaneous strain with the value of 0.16% was obtained for Mn{sub 48}Ni{sub 42}Sn{sub 10} alloys.

ExoMol line lists - XXIX. The rotation-vibration spectrum of methyl chloride up to 1200 K

Science.gov (United States)

Owens, A.; Yachmenev, A.; Thiel, W.; Fateev, A.; Tennyson, J.; Yurchenko, S. N.

2018-06-01

Comprehensive rotation-vibration line lists are presented for the two main isotopologues of methyl chloride, 12CH335Cl and 12CH337Cl. The line lists, OYT-35 and OYT-37, are suitable for temperatures up to T = 1200 K and consider transitions with rotational excitation up to J = 85 in the wavenumber range 0-6400 cm-1 (wavelengths λ > 1.56 μm). Over 166 billion transitions between 10.2 million energy levels have been calculated variationally for each line list using a new empirically refined potential energy surface, determined by refining to 739 experimentally derived energy levels up to J = 5, and an established ab initio dipole moment surface. The OYT line lists show excellent agreement with newly measured high-temperature infrared absorption cross-sections, reproducing both strong and weak intensity features across the spectrum. The line lists are available from the ExoMol database and the CDS database.

Polymorphic phase transition and morphotropic phase boundary in Ba{sub 1-x}Ca{sub x}Ti{sub 1-y}Zr{sub y}O{sub 3} ceramics

Energy Technology Data Exchange (ETDEWEB)

Abdessalem, M. Ben; Aydi, S.; Aydi, A.; Abdelmoula, N.; Khemakhem, H. [Universite de Sfax, Faculte des Sciences de Sfax (FSS), Laboratoire des Materiaux Multifonctionnels et Applications (LaMMA) LR16ES18, B.P.1171, Sfax (Tunisia); Sassi, Z. [Laboratoire de Genie Electrique et Ferroelectricite (LGEF) de L' INSA de Lyon, Lyon (France)

2017-09-15

This paper deals with Ca and Zr co-doped BaTiO{sub 3} (BCTZ{sub (x,} {sub y)}) (x = 0.1, 0.13, 0.2 and y = 0.05, 0.1, 0.15). These ceramics were prepared using the conventional solid state method. The symmetry, dielectric properties, Raman spectroscopy, ferroelectric behavior and piezoelectric effect were examined. X-ray diffraction (XRD) results display that morphotropic boundary occurs from tetragonal to orthorhombic region of BCZT{sub (x=0.1,} {sub 0.2,} {sub y=0.05,} {sub 0.1)} and polymorphic phase transitions from tetragonal to orthorhombic, orthorhombic to rhombohedral regions of BCZT{sub (x=0.13,} {sub y=0.1)}. The evolution of the Raman spectra was investigated as a function of compositions at room temperature, in correlation with XRD analysis and dielectric measurements. We note that the substitution of Ca in Ba site and Zr ions in Ti site slightly decreased the cubic-tetragonal temperature transition (T{sub C}) and increased the orthorhombic-tetragonal (T{sub 1}) and rhombohedral-orthorhombic (T{sub 2}) temperatures transitions. The ferroelectric properties were examined by a P-E hysteresis loop. The two parameters ΔT{sub 1} and ΔT{sub 2} are defined as ΔT{sub 1} = T{sub C} - T{sub 1} and ΔT{sub 2} = T{sub C} - T{sub 2}, they come close to T{sub C} for x = 0.13, y = 0.1, which reveals that this composition is around the polymorphic phase. The excellent piezoelectric coefficient of d{sub 33} = 288 pC N{sup -1}, the electromechanical coupling factor k{sub p} = 40%, high constant dielectric 9105, coercive field E{sub c} = 0.32 (KV mm{sup -1}) and remanent polarization P{sub r} = 0.1 (μc mm{sup -2}) were obtained for composition x = 0.13, y = 0.1. (orig.)

Low-density to high-density transition in Ce{sub 75}Al{sub 23}Si{sub 2} metallic glass

Energy Technology Data Exchange (ETDEWEB)

Zeng, Q S; Lou, H B; Gong, Y; Wang, X D; Jiang, J Z [International Center for New-Structured Materials, Zhejiang University, Hangzhou 310027 (China); Fang, Y Z; Wu, F M [College of Mathematics, Physics and Information Engineering, Zhejiang Normal University, Jinhua 321004, Zhejiang (China); Yang, K; Li, A G; Yan, S; Yu, X H [Shanghai Institute of Applied Physics, Chinese Academy of Sciences, Shanghai 201203 (China); Lathe, C, E-mail: qiaoshizeng@gmail.co, E-mail: jiangjz@zju.edu.c [HASYLAB am DESY, Notkestrasse 85, Hamburg D-22603 (Germany)

2010-09-22

Using in situ high-pressure x-ray diffraction (XRD), we observed a pressure-induced polyamorphic transition from the low-density amorphous (LDA) state to the high-density amorphous (HDA) state in Ce{sub 75}Al{sub 23}Si{sub 2} metallic glass at about 2 GPa and 300 K. The thermal stabilities of both LDA and HDA metallic glasses were further investigated using in situ high-temperature and high-pressure XRD, which revealed different pressure dependences of the onset crystallization temperature (T{sub x}) between them with a turning point at about 2 GPa. Compared with Ce{sub 75}Al{sub 25} metallic glass, minor Si doping shifts the onset polyamorphic transition pressure from 1.5 to 2 GPa and obviously stabilizes both LDA and HDA metallic glasses with higher T{sub x} and changes their slopes dT{sub x}/dP. The results obtained in this work reveal another polyamorphous metallic glass system by minor alloying (e.g. Si), which could modify the transition pressure and also properties of LDA and HDA metallic glasses. The minor alloying effect reported here is valuable for the development of more polyamorphous metallic glasses, even multicomponent bulk metallic glasses with modified properties, which will trigger more investigations in this field and improve our understanding of polyamorphism and metallic glasses.

Calculation of energetic characteristics of 3d-transition metal ion aquacomplexes in tetrahedral and octahedral coordination by broadened Hukkel method

International Nuclear Information System (INIS)

Zhogolev, D.A.; Bunyatyan, B.Kh.; Yatsimirskij, K.B.

1975-01-01

Aquacomplexes formation energies of bi- and trivalent ions of 3d transition metals from Sc to Ni in the tetrahedral and octahedral coordinations have been calculated to compare their energetic advantages. Unlike ions of alkali metals and halogens, a tendency for higher or at least equal energetic effect of the formation of a tetrahedral complex, compared to octahedral, is characteristic of the ions under study. This can be explained by an increase in the covalency degree of the bond ion-ligand and by a considerable charge transfer from ligands to the central ion in the case of transition elements

The photoluminescent property and optical transition analysis of host sensitized Ca{sub 0.5}Sr{sub 0.5}MoO{sub 4}:Dy{sup 3+} phosphor

Energy Technology Data Exchange (ETDEWEB)

Yang, Zhiping; Hou, Chuncai [College of Physics and Technology, Hebei University, Baoding, Hebei 071002 (China); Duan, Guangjie [College of Electronics and Information Engineering, Hebei University, Baoding, Hebei 071002 (China); Yang, Fu [College of Physics and Technology, Hebei University, Baoding, Hebei 071002 (China); College of Science, Hebei North University, Zhangjiakou 075000 (China); Liu, Pengfei; Wang, Can [College of Physics and Technology, Hebei University, Baoding, Hebei 071002 (China); Liu, Lipeng [College of Electronics and Information Engineering, Hebei University, Baoding, Hebei 071002 (China); Dong, Guoyi, E-mail: dongguoyitxzz@163.com [College of Physics and Technology, Hebei University, Baoding, Hebei 071002 (China)

2014-08-01

Highlights: • A novel host sensitized Ca{sub 0.5−x}Sr{sub 0.5}MoO{sub 4}:xDy{sup 3+} phosphors could be synthesized by solid state reaction. • The XRD and SEM figures were made to analyze the crystal phase and morphology of Ca{sub 0.5−x}Sr{sub 0.5}MoO{sub 4}:xDy{sup 3+} phosphors. • We research the emission and excitation properties by analyzing the relevant optical transition. • The energy transition is proved to exist by the analysis on luminescence spectra and luminescence decay curves. • The chromaticity coordinate of Ca{sub 0.5−x}Sr{sub 0.5}MoO{sub 4}:xDy{sup 3+} will be tunable as changing x. - Abstract: A series of Dy{sup 3+} doped Ca{sub 0.5}Sr{sub 0.5}MoO{sub 4} phosphors were synthesized by solid state reaction. The structure and the photoluminescent (PL) properties of the as-prepared powders were characterized by X-ray diffraction (XRD), field emission scanning electron microscope and fluorescent spectrophotometry. The analyses on optical transition of Ca{sub 0.5}Sr{sub 0.5}MoO{sub 4}:xDy{sup 3+} phosphors indicate that the broad band of excitation spectrum comes from the charge transmission. The broad band of excitation spectrum matches well with the excitation energy level of Dy{sup 3+}, indicating the energy transfer from the host to Dy{sup 3+}. The chromaticity coordinates changed from blue–green to yellow area depending on the Dy{sup 3+} concentration. In addition, the main mechanism of the concentration quenching was the electric multiple interaction between Dy{sup 3+} ions.

Pressure-induced phase transitions in Zr-rich PbZr{sub 1-x}Ti{sub x}O{sub 3} ceramics

Energy Technology Data Exchange (ETDEWEB)

Souza Filho, A.G. [Departamento de Fisica, Universidade Federal do Ceara, Fortaleza, Ceara (Brazil)]. E-mail: agsf@fisica.ufc.br; Faria, J.L.B.; Freire, P.T.C.; Ayala, A.P.; Sasaki, J.M.; Melo, F.E.A.; Mendes Filho, J. [Departamento de Fisica, Universidade Federal do Ceara, Fortaleza, Ceara (Brazil); Araujo, E.B. [Departamento de Fisica e Quimica, Universidade Estadual de Sao Paulo, Campus de Ilha Solteira, Ilha Solteira, SP (Brazil); Eiras, J.A. [Departamento de Fisica, Universidade Federal de Sao Carlos, Sao Carlos, SP (Brazil)

2001-08-20

A Raman study of structural changes in the Zr-rich PbZr{sub 1-x}Ti{sub x}O{sub 3} (PZT) system under hydrostatic pressures up to 5.0 GPa is presented. We observe that externally applied pressure induces several phase transitions in PZT ceramics among phases with orthorhombic (A{sub O}), rhombohedral low-temperature (R{sub LT}), and rhombohedral high-temperature (R{sub HT}) symmetries (all found in PZT at ambient pressure and room temperature). Each of the compositions investigated (0.02{<=}x{<=}0.14) exhibits a high-pressure phase with orthorhombic (O{sub I'}) symmetry. We further report a detailed study of the pressure dependence of Raman frequencies to elucidate the phase transitions and to provide a set of pressure coefficients for the high-pressure phases. (author)

Study of the magnetic phase transitions and magnetocaloric effect in Dy{sub 2}Cu{sub 2}In compound

Energy Technology Data Exchange (ETDEWEB)

Zhang, Yikun, E-mail: ykzhang10@hotmail.com [State Key Laboratory of Advanced Special Steels, Shanghai University, Shanghai, 200072 (China); Shanghai Key Laboratory of Advanced Ferrometallurgy, Shanghai University, Shanghai, 200072 (China); School of Materials Science and Engineering, Shanghai University, 200072 (China); Institute of Materials Physics, University of Münster, Wilhelm-Klemm-Straße 10, D-48149, Münster (Germany); Xu, Xiao; Yang, Yang; Hou, Long; Ren, Zhongming [State Key Laboratory of Advanced Special Steels, Shanghai University, Shanghai, 200072 (China); Shanghai Key Laboratory of Advanced Ferrometallurgy, Shanghai University, Shanghai, 200072 (China); School of Materials Science and Engineering, Shanghai University, 200072 (China); Li, Xi, E-mail: lx_net@sina.com [State Key Laboratory of Advanced Special Steels, Shanghai University, Shanghai, 200072 (China); Shanghai Key Laboratory of Advanced Ferrometallurgy, Shanghai University, Shanghai, 200072 (China); School of Materials Science and Engineering, Shanghai University, 200072 (China); Wilde, Gerhard [Institute of Materials Physics, University of Münster, Wilhelm-Klemm-Straße 10, D-48149, Münster (Germany)

2016-05-15

The magnetic properties and magnetocaloric effect (MCE) in Dy{sub 2}Cu{sub 2}In compound have been investigated. Dy{sub 2}Cu{sub 2}In undergoes two magnetic phase transitions, a paramagnetic to ferromagnetic (FM) at T{sub C} ∼ 49.5 K followed by a spin reorientation (SR) at T{sub SR} ∼ 19.5 K. For a magnetic field change of 0–7 T, the maximum values of the magnetic entropy change (−ΔS{sub M}{sup max}) are estimated to be 16.5 around T{sub C} and 6.7 J/kg K around T{sub SR} with a large relative cooling power (RCP) value of 617 J/kg. The modified Arrott plots and universal curves of the rescaled ΔS{sub M} confirmed that the magnetic phase transitions in Dy{sub 2}Cu{sub 2}In compound belongs the second order phase transitions. The present results may provide some clues to search for new magnetocaloric materials belonging to RE{sub 2}T{sub 2}X system. - Highlights: • Magnetic properties and magnetocaloric effect in Dy{sub 2}Cu{sub 2}In was studied. • The Dy{sub 2}Cu{sub 2}In undergoes 2 s order magnetic phase transitions. • A large reversible MCE was observed in Dy{sub 2}Cu{sub 2}In. • The origin of MCE and its potential application in Dy{sub 2}Cu{sub 2}In were discussed.

Observation of the Forbidden Magnetic Dipole Transition 6{sup 2}P{sub ½} --> 7{sup 2}P{sub ½} in Atomic Thallium

Science.gov (United States)

Chu, S.

1976-10-01

A measurement of the 6{sup 2}P{sub ½} --> 7{sup 2}P{sub ½} forbidden magnetic dipole matrix element in atomic thallium is described. A pulsed, linearly polarized dye laser tuned to the transition frequency is used to excite the thallium vapor from the 6{sup 2}P{sub ½} ground state to the 7{sup 2}P{sub ½} excited state. Interference between the magnetic dipole M1 amplitude and a static electric field induced E1 amplitude results in an atomic polarization of the 7{sup 2}P{sub ½} state, and the subsequent circular polarization of 535 nm fluorescence. The circular polarization is seen to be proportional to / as expected, and measured for several transitions between hyperfine levels of the 6{sup 2}P{sub ½} and 7{sup 2}P{sub ½} states. The result is = -(2.11 +- 0.30) x 10{sup -5} parallel bar e parallel bar dirac constant/2mc, in agreement with theory.

Multiple superconducting transition and phase separation in melt-textured YBa{sub 2}Cu{sub 3}O{sub 7−d}

Energy Technology Data Exchange (ETDEWEB)

Menegotto Costa, R. [Instituto de Matemática, Estatística e Física, Universidade Federal do Rio Grande (FURG), Campus Carreiros, Rio Grande, RS (Brazil); Dias, F.T. [Instituto de Física e Matemática, Universidade Federal de Pelotas (UFPel), Caixa Postal 354, 96010-900 Pelotas, RS (Brazil); Pureur, P., E-mail: ppureur@if.ufrgs.br [Instituto de Física, Universidade Federal do Rio Grande do Sul (UFRGS), Caixa Postal 15051, 91501-970 Porto Alegre, RS (Brazil); Obradors, X. [Institut de Ciéncia de Materials de Barcelona, CSIC, Universitat Autònoma de Barcelona, 08193 Bellaterra (Spain)

2013-12-15

Highlights: •We report on experimental measurements of the temperature derivative of the resistivity in the region encompassing the superconducting transition in melt-textured samples of the YBa{sub 2}Cu{sub 3}O{sub 7−d} cuprate superconductor. •A complex and subtle multi-peak structure is observed in d{ρ}/dT. •We develop a new method to quantitatively describe the resistive transition of a multi-phased superconductor. •The pseudo-spectral structure observed in d{ρ}/dT is ascribed to a phase separation phenomenon driven by the ordering of labile oxygen atoms in the Cu–O chain substructure. -- Abstract: We report on careful measurements of the temperature derivative of the resistivity, dρ/dT, in the region encompassing the superconducting transition of melt-textured samples of the YBa{sub 2}Cu{sub 3}O{sub 7−d} cuprate superconductor. Measurements were carried out in orientations parallel and perpendicular to the Cu − O{sub 2} atomic planes in the presence of small magnetic fields applied parallel to the current orientation. The dρ/dT results reveal the occurrence of complex multi-peak structures that were analyzed with a new method based on the assumption that a simple series association of conductivities is adequate for describing the resistive transition of multiphased superconductors. We ascribe the multi-peak structure observed in the derivative measurements to a subtle and complex phase separation phenomenon leading to the stabilization of domains having slightly different electronic properties that are related to the ordering of labile oxygen atoms in the YBa{sub 2}Cu{sub 3}O{sub 7−d} chain sub-structure.

Dielectric determination of the glass transition temperature (T sub g)

Science.gov (United States)

Ries, Heidi R.

1990-01-01

The objective is to determine the glass transition temperature of a polymer using a dielectric dissipation technique. A peak in the dissipation factor versus temperature curve is expected near the glass transition temperature T sub g. It should be noted that the glass transition is gradual rather than abrupt, so that the glass transition temperature T sub g is not clearly identifiable. In this case, the glass transition temperature is defined to be the temperature at the intersection point of the tangent lines to the dissipation factor versus temperature curve above and below the transition region, as illustrated.

Studies of the pressure-induced phase transition of C sub 3 N sub 6 H sub 6

CERN Document Server

Ma Hong An; Cui Qi Liang; Pan Yue Wu; Zhu Pin Wen; Guo Wei; Chen Li Xue; Ren Guo Zheng; Zou Guang Tian; LiuJing

2002-01-01

In situ high pressure energy dispersive X-ray diffraction experiments have been carried out on C sub 3 N sub 6 H sub 6 by using diamond anvil cell (DAC) device with synchrotron radiation source. Two structural phase transitions of C sub 3 N sub 6 H sub 6 have been observed within 14.7 GPa pressure range, from monoclinic to triclinic structure at 1.3 GPa and from triclinic to orthorhombic structure at 8.2 GPa, respectively

The location of energetic compartments affects energetic communication in cardiomyocytes

Directory of Open Access Journals (Sweden)

Rikke eBirkedal

2014-09-01

Full Text Available The heart relies on accurate regulation of mitochondrial energy supply to match energy demand. The main regulators are Ca2+ and feedback of ADP and Pi. Regulation via feedback has intrigued for decades. First, the heart exhibits a remarkable metabolic stability. Second, diffusion of ADP and other molecules is restricted specifically in heart and red muscle, where a fast feedback is needed the most. To explain the regulation by feedback, compartmentalization must be taken into account. Experiments and theoretical approaches suggest that cardiomyocyte energetic compartmentalization is elaborate with barriers obstructing diffusion in the cytosol and at the level of the mitochondrial outer membrane (MOM. A recent study suggests the barriers are organized in a lattice with dimensions in agreement with those of intracellular structures. Here, we discuss the possible location of these barriers. The more plausible scenario includes a barrier at the level of MOM. Much research has focused on how the permeability of MOM itself is regulated, and the importance of the creatine kinase system to facilitate energetic communication. We hypothesize that at least part of the diffusion restriction at the MOM level is not by MOM itself, but due to the close physical association between the sarcoplasmic reticulum (SR and mitochondria. This will explain why animals with a disabled creatine kinase system exhibit rather mild phenotype modifications. Mitochondria are hubs of energetics, but also ROS production and signaling. The close association between SR and mitochondria may form a diffusion barrier to ADP added outside a permeabilised cardiomyocyte. But in vivo, it is the structural basis for the mitochondrial-SR coupling that is crucial for the regulation of mitochondrial Ca2+-transients to regulate energetics, and for avoiding Ca2+-overload and irreversible opening of the mitochondrial permeability transition pore.

Evidence for plasma phase transition in high pressure hydrogen from ab-initio simulations

Energy Technology Data Exchange (ETDEWEB)

Morales, M; Pierleoni, C; Schwegler, E; Ceperley, D

2010-02-08

We have performed a detailed study of molecular dissociation in liquid hydrogen using both Born-Oppenheimer molecular dynamics with Density Functional Theory and Coupled Electron-Ion Monte Carlo simulations. We observe a range of densities where (dP/d{rho}){sub T} = 0 that coincides with sharp discontinuities in the electronic conductivity, which is clear evidence of the plasma phase transition for temperatures 600K {le} T {le} 1500K. Both levels of theory exhibit the transition, although Quantum Monte Carlo predicts higher transition pressures. Based on the temperature dependence of the discontinuity in the electronic conductivity, we estimate the critical point of the transition at temperatures slightly below 2000 K. We examine the influence of proton zero point motion by using Path Integral Molecular Dynamics with Density Functional Theory; the main effect is to shift the transition to lower pressures. Furthermore, we calculate the melting curve of molecular hydrogen up to pressures of 200 GPa, finding a reentrant melting line in good agreement with previous calculations. The melting line crosses the metalization line at 700 K and 220 GPa using density functional energetics and at 550 K and 290 GPa using Quantum Monte Carlo energetics.

Inversion of spin levels in Ni sup 2 sup + : Zn(BF sub 4) sub 2 centre dot 6H sub 2 O at all -round compression and effect of transition coincidence

CERN Document Server

Krygin, I M; Nejlo, G N; Prokhorov, A D

2001-01-01

The study of the EPR spectrum of the Ni sup 2 sup + ion, replacing Zn sup 2 sup + in the Zn(BF sub 4) centre dot 6H sub 2 O crystals in the wide temperature range by the all-round compression in the X- and Q-ranges is carried out. The basic changes by varying temperature and pressure occur with the D parameter, characterizing the initial splitting by practically unchanged g-factor. The increase in the temperature is accompanied by the D nonlinear growth. The all-round compression linearly changes the initial splitting and leads to the change in the D-sign, signifying the spin levels inversion by 3.5 kbar. Coincidence of EPR lines, relative to different transitions, leads to the crevasse appearance in the outline of this one, that is connected with cross-relaxation inside the spin system

ExoLocator--an online view into genetic makeup of vertebrate proteins.

Science.gov (United States)

Khoo, Aik Aun; Ogrizek-Tomas, Mario; Bulovic, Ana; Korpar, Matija; Gürler, Ece; Slijepcevic, Ivan; Šikic, Mile; Mihalek, Ivana

2014-01-01

ExoLocator (http://exolocator.eopsf.org) collects in a single place information needed for comparative analysis of protein-coding exons from vertebrate species. The main source of data--the genomic sequences, and the existing exon and homology annotation--is the ENSEMBL database of completed vertebrate genomes. To these, ExoLocator adds the search for ostensibly missing exons in orthologous protein pairs across species, using an extensive computational pipeline to narrow down the search region for the candidate exons and find a suitable template in the other species, as well as state-of-the-art implementations of pairwise alignment algorithms. The resulting complements of exons are organized in a way currently unique to ExoLocator: multiple sequence alignments, both on the nucleotide and on the peptide levels, clearly indicating the exon boundaries. The alignments can be inspected in the web-embedded viewer, downloaded or used on the spot to produce an estimate of conservation within orthologous sets, or functional divergence across paralogues.

Second order magnetic phase transition and scaling analysis in iron doped manganite La{sub 0.7}Ca{sub 0.3}Mn{sub 1−x}Fe{sub x}O{sub 3} compounds

Energy Technology Data Exchange (ETDEWEB)

Ginting, Dianta [Department of Applied Physics and Institute of Natural Sciences, Kyung Hee University, Yong-in 446-701 (Korea, Republic of); Nanto, Dwi [Physics Education, Syarif Hidayatullah State Islamic University, Jakarta 15412 (Indonesia); Denny, Yus Rama [Department of Electrical Engineering, University of Sultan Ageng Tirtayasa, Banten 42435 (Indonesia); Tarigan, Kontan [Department of Mechanical Engineering, Mercu Buana University, Jakarta-Barat, Jakarta 11650 (Indonesia); Hadi, Syamsul [Department of Mechanical Engineering, State Polytechnic of Malang, East Java 65100 (Indonesia); Ihsan, Mohammad [PSTBM-BATAN, Kawasan Puspiptek Serpong, Tangerang Selatan, Banten 15314 (Indonesia); Institute of Electronic Materials, University of Wollongong, Wollongong NSW 2522 (Australia); Rhyee, Jong-Soo, E-mail: jsrhyee@khu.ac.kr [Department of Applied Physics and Institute of Natural Sciences, Kyung Hee University, Yong-in 446-701 (Korea, Republic of)

2015-12-01

We investigated magnetic properties of La{sub 0.7}Ca{sub 0.3}Mn{sub 1−x}Fe{sub x}O{sub 3} (x=0.09 and 0.11) compounds in terms of isothermal magnetization analysis and scaling behavior with various critical exponents. From the Landau theory of magnetic phase transition, we found that the paramagnetic to ferromagnetic phase transition in La{sub 0.7}Ca{sub 0.3}Mn{sub 1−x}Fe{sub x}O{sub 3} (x=0.09 and 0.11) compounds is the type of second order magnetic transition (SOMT), which contrary to the first order magnetic transition (FOMT) for low Fe-doped compounds (x<0.09) in previous reports. When we investigate the critical behavior of the compounds near T=T{sub c} by the modified Arrott plot, Kouvel–Fisher plots, and critical isothermal analysis, the estimated critical exponents β, γ, and δ are in between the theoretically predicted values for three-dimensional Heisenberg and mean-field interaction models. It is noteworthy that the scaling relations are obeyed in terms of renormalization magnetization m=ε{sup −β}M(H,ε) and renormalized field h=|ε|{sup β+γ}H. Temperature-dependent effective exponents β{sub eff} and γ{sub eff} correspond to the ones of disordered ferromagnets. It is shown that the magnetic state of the compounds is not fully described by the conventional localized-spin interaction model because the ferromagnetic interaction has itinerant character by increasing Fe-doping concentration. - Highlights: • The ferromagnetic phase transition is of second order in La{sub 0.7}Ca{sub 0.3}Mn{sub 1−x}Fe{sub x}O{sub 3}. • The critical exponents are in between the 3D Heisenberg and mean-field models. • The ferromagnetic interaction becomes more itinerant by Fe-doping.

Phase transition of the orthorhombic fluorite-related compounds Ln{sub 3}IrO{sub 7} (Ln = Pr, Nd, Sm, Eu)

Energy Technology Data Exchange (ETDEWEB)

Hinatsu, Yukio, E-mail: hinatsu@sci.hokudai.ac.j [Division of Chemistry, Graduate School of Science, Hokkaido University, Sapporo 060-0810 (Japan); Doi, Yoshihiro; Nishimine, Hiroaki; Wakeshima, Makoto [Division of Chemistry, Graduate School of Science, Hokkaido University, Sapporo 060-0810 (Japan); Sato, Mineo [Department of Chemistry and Chemical Engineering, Faculty of Engineering, Niigata University, 8050 Ikarashi 2-nocho, Niigata 950-2181 (Japan)

2009-12-04

Rare earth iridium oxides Ln{sub 3}IrO{sub 7} (Ln = Pr, Nd, Sm, and Eu) were prepared and their structures were determined by X-ray diffraction measurements. At room temperature, Pr{sub 3}IrO{sub 7} crystallized in an orthorhombic superstructure of cubic fluorite with space group Cmcm. The differential thermal analysis (DTA) and specific heat measurements for Ln{sub 3}IrO{sub 7} (Ln = Pr, Nd, Sm, and Eu) showed a phase transition at 262, 342, 420, and 485 K, respectively. At low temperatures, Ln{sub 3}IrO{sub 7} crystallized in a monoclinic structure with the space group P2{sub 1}/n. The transition temperatures increased with decreasing the ionic radius of rare earths, which indicates that the transition is stress-induced and occurs with the lattice contraction on cooling. These results for Ln{sub 3}IrO{sub 7} were compared with the phase transitions observed for Ln{sub 3}MoO{sub 7}, Ln{sub 3}RuO{sub 7}, Ln{sub 3}ReO{sub 7}, and Ln{sub 3}OsO{sub 7}.

The 2s2p 4P0sub(5/2) - 2p24Psup(e)sub(5/2)-transition in O VI

International Nuclear Information System (INIS)

Sjoedin, R.; Pihl, J.; Hallin, R.; Lindskog, J.; Marelius, A.

1976-03-01

The Li-like doubly excited transitions 2s2p 4 P 0 sub(5/2) - 2p 2 4 Psup(e)sub(5/2) in O VI has been studied with the beam-foil technique. Oxygen ion beams with energies between 4.5 to 9 MeV were used. The wavelength of the transition was measured to 944.0+-0.5 A and the lifetime for the upper level 2p 2 4 Psup(e) was measured to be 0.51+-0.04 ns. (Auth.)

Thermotropic phase transitions in Pb{sub 1−x}Sr{sub x}(Al{sub 1/3}Nb{sub 2/3}){sub 0.1}(Zr{sub 0.52}Ti{sub 0.48}){sub 0.9}O{sub 3} ceramics: Temperature dependent dielectric permittivity and Raman scattering

Energy Technology Data Exchange (ETDEWEB)

Li, C. Q.; Peng, L.; Jiang, K.; Hu, Z. G., E-mail: zghu@ee.ecnu.edu.cn; Chu, J. H. [Key Laboratory of Polar Materials and Devices, Ministry of Education, Department of Electronic Engineering, East China Normal University, Shanghai 200241 (China); Wang, P.; Liu, A. Y. [Department of Physics, Shanghai Normal University, Shanghai 200234 (China)

2015-06-15

The phase transitions of Pb{sub 1−x}Sr{sub x}(Al{sub 1/3}Nb{sub 2/3}){sub 0.1}(Zr{sub 0.52}Ti{sub 0.48}){sub 0.9}O{sub 3} (Sr-modified PAN-PZT) ceramics with Sr compositions of x = 2%, 5%, 10% and 15% have been investigated using X-ray diffraction (XRD), temperature dependent dielectric permittivity and Raman scattering. The XRD analysis show that the phase transition occurs between Sr composition of 5% and 10%. Based on the broad dielectric peaks at 100 Hz, the diffused phase transition from tetragonal (T) to cubic (C) structure shifts to lower temperature with increasing Sr composition. The dramatic changes of wavenumber and full width at half-maximum (FWHM) for E(TO{sub 4})′ softing mode can be observed at morphotropic phase boundary (MPB). Moreover, the MPB characteristic shows a wider and lower trend of temperature region with increasing Sr composition. It could be ascribed to the diminishment of the energy barrier and increment of A-cation entropy. Therefore, the Sr-modified PAN-PZT ceramics unambiguously undergo two successive structural transitions (rhombohedral-tetragonal-cubic phase) with temperature from 80 to 750 K. Correspondingly, the phase diagram of Sr-modified PAN-PZT ceramics can be well depicted.

Photocatalytic reduction of Cr(VI) on the new hetero-system CuAl{sub 2}O{sub 4}/TiO{sub 2}

Energy Technology Data Exchange (ETDEWEB)

Gherbi, R. [Laboratory of Reaction Engineering, Faculty of Mechanic and Engineering Processes, USTHB, BP 32, 16111 Algiers (Algeria); Nasrallah, N. [Laboratory of Reaction Engineering, Faculty of Mechanic and Engineering Processes, USTHB, BP 32, 16111 Algiers (Algeria); Equipe chimie et Ingenierie des procedes, UMR CNRS 6226, E.N.S.C.R., Avenue du General Leclerc, CS 50837, 35708 Rennes Cedex 7 (France); Amrane, A. [Equipe chimie et Ingenierie des procedes, UMR CNRS 6226, E.N.S.C.R., Avenue du General Leclerc, CS 50837, 35708 Rennes Cedex 7 (France); Maachi, R. [Laboratory of Reaction Engineering, Faculty of Mechanic and Engineering Processes, USTHB, BP 32, 16111 Algiers (Algeria); Trari, M., E-mail: solarchemistry@gmail.com [Laboratory of Storage and Valorization of Renewable Energies, Faculty of Chemistry, USTHB, BP 32, 16111 Algiers (Algeria)

2011-02-28

Visible light driven HCrO{sub 4}{sup -} reduction was successfully achieved over the new hetero-system CuAl{sub 2}O{sub 4}/TiO{sub 2}. The spinel, elaborated by nitrate route, was characterized photo electrochemically. The optical gap was found to be 1.70 eV and the transition is directly allowed. The conduction band (-1.05 V{sub SCE}) is located below that of TiO{sub 2}, more negative than the HCrO{sub 4}{sup -}/Cr{sup 3+} level (+0.58 V{sub SCE}) yielding a thermodynamically feasible chromate reduction upon visible illumination. CuAl{sub 2}O{sub 4} is stable against photo corrosion by holes consumption reaction involving salicylic acid which favors the charges separation. There is a direct correlation between the dark adsorption and the photo activity. A reduction of more than 95% of chromate was achieved after 3 h irradiation at pH 2 with an optimal mass ratio (CuAl{sub 2}O{sub 4}/TiO{sub 2}) equal to 1/3. The reduction follows a first order kinetic with a half life of {approx}1 h and a quantum yield of 0.11% under polychromatic light. Prolonged illumination was accompanied by a deceleration of the Cr(VI) reduction thanks to the competitive water discharge. The hydrogen evolution, an issue of energetic concern, took place with a rate of 3.75 cm{sup 3} (g catalyst){sup -1} h{sup -1}.

SIMULATION OF ENERGETIC NEUTRAL ATOMS FROM SOLAR ENERGETIC PARTICLES

Energy Technology Data Exchange (ETDEWEB)

Wang, Linghua [Institute of Space Physics and Applied Technology, Peking University, Beijing 100871 (China); Li, Gang [Department of Space Science and CSPAR, University of Alabama in Huntsville, Huntsville, AL 35899 (United States); Shih, Albert Y. [Solar Physics Laboratory, NASA Goddard Space Flight Center, Greenbelt, MD 20770 (United States); Lin, Robert P. [Space Sciences Laboratory, University of California, Berkeley, CA 94720-7450 (United States); Wimmer-Schweingruber, Robert F., E-mail: wanglhwang@gmail.com [Institut fuer Experimentelle und Angewandte Physik, University of Kiel, Leibnizstrasse 11, D-24118 Kiel (Germany)

2014-10-01

Energetic neutral atoms (ENAs) provide the only way to observe the acceleration site of coronal-mass-ejection-driven (CME-driven) shock-accelerated solar energetic particles (SEPs). In gradual SEP events, energetic protons can charge exchange with the ambient solar wind or interstellar neutrals to become ENAs. Assuming a CME-driven shock with a constant speed of 1800 km s{sup –1} and compression ratio of 3.5, propagating from 1.5 to 40 R{sub S} , we calculate the accelerated SEPs at 5-5000 keV and the resulting ENAs via various charge-exchange interactions. Taking into account the ENA losses in the interplanetary medium, we obtain the flux-time profiles of these solar ENAs reaching 1 AU. We find that the arriving ENAs at energies above ∼100 keV show a sharply peaked flux-time profile, mainly originating from the shock source below 5 R{sub S} , whereas the ENAs below ∼20 keV have a flat-top time profile, mostly originating from the source beyond 10 R{sub S} . Assuming the accelerated protons are effectively trapped downstream of the shock, we can reproduce the STEREO ENA fluence observations at ∼2-5 MeV/nucleon. We also estimate the flux of ENAs coming from the charge exchange of energetic storm protons, accelerated by the fast CME-driven shock near 1 AU, with interstellar hydrogen and helium. Our results suggest that appropriate instrumentation would be able to detect ENAs from SEPs and to even make ENA images of SEPs at energies above ∼10-20 keV.

Solid solubility, phase transitions, thermal expansion, and compressibility in Sc{sub 1−x}Al{sub x}F{sub 3}

Energy Technology Data Exchange (ETDEWEB)

Morelock, Cody R.; Gallington, Leighanne C. [School of Chemistry and Biochemistry, Georgia Institute of Technology, Atlanta, GA 30332-0400 (United States); Wilkinson, Angus P., E-mail: angus.wilkinson@chemistry.gatech.edu [School of Chemistry and Biochemistry, Georgia Institute of Technology, Atlanta, GA 30332-0400 (United States); School of Materials Science and Engineering, Georgia Institute of Technology, Atlanta, GA 30332-0245 (United States)

2015-02-15

With the goal of thermal expansion control, the synthesis and properties of Sc{sub 1−x}Al{sub x}F{sub 3} were investigated. The solubility limit of AlF{sub 3} in ScF{sub 3} at ∼1340 K is ∼50%. Solid solutions (x≤0.50) were characterized by synchrotron powder diffraction at ambient pressure between 100 and 900 K and at pressures <0.414 GPa while heating from 298 to 523 K. A phase transition from cubic to rhombohedral is observed. The transition temperature increases smoothly with Al{sup 3+} content, approaching 500 K at the solid solubility limit, and also upon compression at fixed Al{sup 3+} content. The slope of the pressure–temperature phase boundary is ∼0.5 K MPa{sup −1}, which is steep relative to that for most symmetry-lowering phase transitions in perovskites. The volume coefficient of thermal expansion (CTE) for the rhombohedral phase is strongly positive, but the cubic-phase CTE varies from negative (x<0.15) to near-zero (x=0.15) to positive (x>0.20) between ∼600 and 800 K. The cubic solid solutions elastically stiffen on heating, while Al{sup 3+} substitution causes softening at a given temperature. - Graphical abstract: The cubic-phase coefficient of thermal expansion for Sc{sub 1−x}Al{sub x}F{sub 3}(solubility limit ∼50% at ∼1340 K) becomes more positive with increased Al{sup 3+} substitution, but the average isothermal bulk modulus decreases (elastic softening). - Highlights: • The solubility limit of AlF{sub 3} in ScF{sub 3} at ∼1340 K is ∼50%. • The phase transition temperature of Sc{sub 1−x}Al{sub x}F{sub 3} increases smoothly with x. • The cubic-phase volume CTE varies from negative to positive with increasing x. • The cubic solid solutions elastically stiffen on heating. • Al{sup 3+} substitution causes softening at a given temperature.

Lifshitz transitions in RCo{sub 5} (R=Y,La) and in Osmium

Energy Technology Data Exchange (ETDEWEB)

Koudela, D.

2007-02-20

The aim of this thesis was to find Lifshitz transitions, which are topological changes of the Fermi surface. The materials under consideration had been YCo{sub 5} and LaCo{sub 5} and Osmium. In all cases the question arose, if the corresponding van Hove singularities are large enough to cause detectable anomalies in the elastic properties. To shift the van Hove singularities through the Fermi energy we used hydrostatic pressure, which is mimicked in the computations by decreasing the volume of the unit cell, where the ratio of the unit cell dimensions c/a is adjusted such that E{sub total}(V)=min{sub (c/a)}E{sub total}(V,c/a). In the case of YCo{sub 5} our calculations yield a first order Lifshitz transition. Here, an extraordinarily large peak in the spin-up part of the DOS, which is caused by a nearly dispersionless band in the hexagonal plane, crosses the Fermi level under a pressure of about 21 GPa. Thus, the spin-up 3d states become partly depopulated, which results in a drop of the total magnetic moment of 35%. Further, the transition results in a volume collapse of 1:4%. Though the volume collapse is isomorphic, it exhibits the following anisotropy: while the lattice constant in the hexagonal plane is almost smoothly contracting with increasing pressure, the lattice constant in c-direction collapses at the transition-pressure. Analogous calculations have been performed for the similar compound LaCo{sub 5}. Here as well we predict a first order Lifshitz transition, taking place at a pressure of about 23 GPa. Again we find a volume collapse under pres- sure together with a decrease of the magnetic moment. The relative volume change amounts to 1:3%. Like in YCo{sub 5}, the unit cell dimensions in the hexagonal plane are decreasing almost smoothly with pressure but in c-direction a jump occurs at the transition-pressure. Also the mechanism of the transition is the same than in YCo{sub 5}. For Osmium we find, that LDA reproduces the ground state volume very well

Enabling Technologies for Characterizing Exoplanet Systems with Exo-C

Science.gov (United States)

Cahoy, Kerri Lynn; Belikov, Ruslan; Stapelfeldt, Karl R.; Chakrabarti, Supriya; Trauger, John T.; Serabyn, Eugene; McElwain, Michael W.; Pong, Christopher M.; Brugarolas, Paul

2015-01-01

The Exoplanet Science and Technology Definition Team's Internal Coronagraph mission design, called 'Exo-C', utilizes several technologies that have advanced over the past decade with support from the Exoplanet Exploration Program. Following the flow of photons through the telescope, the science measurement is enabled by (i) a precision pointing system to keep the target exoplanet system precisely positioned on the detector during the integration time, (ii) high-performance coronagraphs to block the parent star's light so that the planet's reflected light can be detected, (iii) a wavefront control system to compensate for any wavefront errors such as those due to thermal or mechanical deformations in the optical path, especially errors with high spatial frequencies that could cause contrast-reducing speckles, and (iv) an integral field spectrograph (IFS) that provides moderate resolution spectra of the target exoplanets, permitting their characterization and comparison with models and other data sets. Technologies such as the wavefront control system and coronagraphs will also benefit from other funded efforts in progress, such as the Wide Field Infrared Survey Telescope Astrophysics Focused Telescope Assets (WFIRST-AFTA) program. Similarly, the Exo-C IFS will benefit from the Prototype Imaging Spectrograph for Coronagraphic Exoplanet Studies (PISCES) demonstration. We present specific examples for each of these technologies showing that the state of the art has advanced to levels that will meet the overall scientific, cost, and schedule requirements of the Exo-C mission. These capabilities have matured with testbed and/or ground-telescope demonstrations and have reached a technological readiness level (TRL) that supports their inclusion in the baseline design for potential flight at the end of this decade. While additional work remains to build and test flight-like components (that concurrently meet science as well as size, weight, power, and environmental

Structural and magnetic properties of transition metal substituted BaFe<sub>2sub>As>2sub> compounds studied by x-ray and neutron scattering

Energy Technology Data Exchange (ETDEWEB)

Kim, Min Gyu [Iowa State Univ., Ames, IA (United States)

2012-01-01

The purpose of my dissertation is to understand the structural and magnetic properties of the newly discovered FeAs-based superconductors and the interconnection between superconductivity, antiferromagnetism, and structure. X-ray and neutron scattering techniques are powerful tools to directly observe the structure and magnetism in this system. I used both x-ray and neutron scattering techniques on different transition substituted BaFe<sub>2sub>As>2sub> compounds in order to investigate the substitution dependence of structural and magnetic transitions and try to understand the connections between them.

Exploring the doping dependence of the Mott transition on X-ray irradiated crystals of {kappa}-(ET){sub 2}Cu[N(CN){sub 2}]Cl

Energy Technology Data Exchange (ETDEWEB)

Koehler, Sebastian; Tutsch, Ulrich; Naji, Ammar; Lang, Michael [Physikalisches Institut, Goethe-Universitaet Frankfurt (Germany); Sasaki, Takahiko [Institute for Materials Research, Tohoku University, Aoba-ku, Sendai, Miyagi (Japan)

2011-07-01

The quasi two-dimensional organic charge-transfer salt {kappa}-(ET){sub 2}Cu[N(CN){sub 2}]Cl exhibits a rich pressure vs. temperature phase diagram, including Mott-insulating and metallic phases separated by a first order transition line. By applying moderate pressures of {proportional_to}30 MPa (300 bar), the ratio of the kinetic energy to the onsite Coulomb repulsion t/U can be changed sufficiently to cross this phase transition line. Our objective is to study the effect of carrier doping and the accompanying changes of the first-order transition line and its second-order critical endpoint. We used X-ray irradiation to introduce charge carriers into the material, doping it away from half filling. We present resistivity data for the temperature range 5 Ksub 2}Cu[N(CN){sub 2}]Cl crystals at various doping levels and discuss the accompanied changes in the p-T-phase diagram.

Optical transitions involving unconfined energy states in In/sub x/Ga/sub 1-//sub x/As/GaAs multiple quantum wells

International Nuclear Information System (INIS)

Ji, G.; Dobbelaere, W.; Huang, D.; Morkoc, H.

1989-01-01

Optical transitions with energies higher than that of the GaAs band gap in highly strained In/sub x/Ga/sub 1-//sub x/As/GaAs multiple--quantum-well structures have been observed in photoreflectance spectra. In some samples as many as seven such structures were present. We identify them as transitions between the unconfined electron states and the confined heavy-hole states. For energies below the GaAs signal, intense transitions corresponding to such unconfined electron subbands were also observed. The intensity of the transitions involving unconfined electron subbands decreases with increasing well width, but is weakly dependent on the mole fraction x. The transmission coefficients are calculated in order to locate the positions of the unconfined electron subband energies. Good agreement is obtained between the experimental data and the theoretical calculation

Effect of chloride substitution on the order–disorder transition in NaBH{sub 4} and Na{sup 11}BD{sub 4}

Energy Technology Data Exchange (ETDEWEB)

Olsen, Jørn Eirik [Institute for Energy Technology, Physics Department, P.O. Box 40, NO-2027 Kjeller (Norway); Karen, Pavel [University of Oslo, Department of Chemistry, P.O. Box 1033 Blindern, NO-0315 Oslo (Norway); Sørby, Magnus H. [Institute for Energy Technology, Physics Department, P.O. Box 40, NO-2027 Kjeller (Norway); Hauback, Bjørn C., E-mail: bjorn.hauback@ife.no [Institute for Energy Technology, Physics Department, P.O. Box 40, NO-2027 Kjeller (Norway)

2014-02-25

Graphical abstract: Interactions that order the BD{sub 4}{sup -} tetrahedra below the order–disorder transition became increasingly frustrated by the solute in the Na({sup 11}BD{sub 4}){sub 1−x}Cl{sub x} solid solutions, and the order disappears at x = 0.158. Highlights: • The order–disorder transition temperature for Na(BH{sub 4}){sub 1−x}Cl{sub x} and Na({sup 11}BD{sub 4}){sub 1−x}Cl{sub x} is highly dependent on the Cl-content, x. • The transition is characterized by DSC for Na({sup 11}BD{sub 4}){sub 1−x}Cl{sub x} for x = 0, 0.10 and 0.15. • No transition is observed for x ⩾ 0.20 on cooling to 8 K. • The crystal structures are reported for Na{sup 11}BD{sub 4} at room temperature and 8 K and Na({sup 11}BD{sub 4}){sub 1−x}Cl{sub x} (x = 0.10, 0.15, 0.20 and 0.25) at 8 K from powder neutron diffraction. -- Abstract: Phase transition associated with anion disordering over two orientations in Na{sup 11}BD{sub 4} (NaBH{sub 4}) and its solid solutions with NaCl, Na({sup 11}BD{sub 4}){sub 1−x}Cl{sub x}, is investigated with powder diffraction (neutron and synchrotron radiation), differential scanning calorimetry and Raman spectroscopy. Upon heating, the transition temperature extrapolated to zero rate of heating is 192.2 K for Na{sup 11}BD{sub 4}, ΔS = 4.41 J/mol K, hysteresis 1.7 K and the volume increase 0.43%. Thermal parameters of the transition in Na({sup 11}BD{sub 4}){sub 1−x}Cl{sub x} follow a colligative-property model of an ideal solution, with x = 0.158(1) as the critical concentration at which the ordering interactions and the transition itself are eliminated. On approaching this limit, the tetragonal distortion of the ordered structure decreases somewhat towards the cubic average, and this is associated with a partial disorder of the tetrahedral anions seen by diffraction methods. In fact, a 3% disorder is already present in the pure solvent of the solid solution (Na{sup 11}BD{sub 4}) at 8 K.

Energetic status of crossbreed dairy cows during transition period in two different seasons

Directory of Open Access Journals (Sweden)

T. F. Moreira

2015-10-01

Full Text Available ABSTRACTWe used 31 crossbreed dairy cows to compare the energetic profile in summer and winter. Blood samples were taken weekly prepartum, at calving and on days 2, 5, 10, 15, 21 and 30 postpartum. All metabolic indicators analyzed were influenced by the physiological status. The glucose concentrations were higher during winter while the triglyceride concentrations and lactate dehydrogenase (LDH were higher in the summer. The season influenced the concentrations of cholesterol, AST and GGT, showing a different pattern between summer and winter. Non-esterified fatty acids (NEFA and beta-hidroxibutirate (BHB were not influenced by the season. Cows that calved during winter had a greater body condition score (BCS and lost more BCS until calving. During summer, 32.26% of the animals and 29.03% during winter had NEFA concentrations above the optimum level and 22.58% of the animals in summer and 19.35% in the winter had subclinical ketosis at some point during the transition period, making then more susceptible to diseases.

Pion transition form factor in k{sub T} factorization

Energy Technology Data Exchange (ETDEWEB)

Li, Hsiang-nan [Academica Sinica, Taipei, Taiwan (China). Inst. of Physics; Tsing-Hua Univ., Hsinchu, Taiwan (China). Dept. of Phyiscs; National Cheng-Kung Univ., Tainan, Taiwan (China). Dept. of Physics; National Cheng-Chi Univ, Taipei, Taiwan (China). Inst. of Applied Physics; Mishima, Satoshi [Deutsches Elektronen-Synchrotron (DESY), Hamburg (Germany)

2009-07-15

It has been pointed out that the recent BaBar data on the {pi}{gamma}{sup *} {yields} {gamma} transition form factor F{sub {pi}}{sub {gamma}}(Q{sup 2}) at low (high) momentum transfer squared Q{sup 2} indicate an asymptotic (flat) pion distribution amplitude. These seemingly contradictory observations can be reconciled in the k{sub T} factorization theorem: the increase of the measured Q{sup 2}FF{sub {pi}}{sub {gamma}}(Q{sup 2}) for Q{sup 2} > 10 GeV{sup 2} is explained by convoluting a k{sub T} dependent hard kernel with a flat pion distribution amplitude, k{sub T} being a parton transverse momentum. The low Q{sup 2} data are accommodated by including the resummation of {alpha}{sub s} ln{sup 2}x, x being a parton momentum fraction, which provides a stronger suppression at the endpoints of x. The next-to-leading-order correction to the pion transition form factor is found to be less than 20% in the considered range of Q{sup 2}. (orig.)

Complex transition metal hydrides incorporating ionic hydrogen: Synthesis and characterization of Na{sub 2}Mg{sub 2}FeH{sub 8} and Na{sub 2}Mg{sub 2}RuH{sub 8}

Energy Technology Data Exchange (ETDEWEB)

Humphries, Terry D., E-mail: terry_humphries81@hotmail.com [WPI-Advanced Institute for Materials Research, Tohoku University, Sendai 980-8577 (Japan); Takagi, Shigeyuki; Li, Guanqiao; Matsuo, Motoaki; Sato, Toyoto [Institute for Materials Research, Tohoku University, Sendai 980-8577 (Japan); Sørby, Magnus H.; Deledda, Stefano; Hauback, Bjørn C. [Physics Department, Institute for Energy Technology, Kjeller NO-2027 (Norway); Orimo, Shin-ichi [WPI-Advanced Institute for Materials Research, Tohoku University, Sendai 980-8577 (Japan); Institute for Materials Research, Tohoku University, Sendai 980-8577 (Japan)

2015-10-05

Highlights: • Structures of Na{sub 2}Mg{sub 2}FeH{sub 8} and Na{sub 2}Mg{sub 2}RuH{sub 8} have been determined by XRD and PND. • Compounds incorporate independently coordinated ionic and covalent hydrogen. • [TH{sub 6}]{sup 4−} anion is surrounded by a cubic array of four Mg{sup 2+} and four Na{sup +} cations. • H{sup −} anions are octahedrally coordinated by four Na{sup +} and two Mg{sup 2+} cations. • Vibrational modes of the H{sup −} anions and complex hydride anion are observed. - Abstract: A new class of quaternary complex transition metal hydrides (Na{sub 2}Mg{sub 2}TH{sub 8} (T = Fe, Ru)) have been synthesized and their structures determined by combined synchrotron radiation X-ray and powder neutron diffraction. The compounds can be considered as a link between ionic and complex hydrides in terms of incorporating independently coordinated ionic and covalent hydrogen. These novel isostructural complex transition metal hydrides crystallize in the orthorhombic space group Pbam, where the octahedral complex hydride anion is surrounded by a cubic array of four Mg{sup 2+} and four Na{sup +} cations, forming distinct two-dimensional layers. An intriguing feature of these materials is the distorted octahedral coordination of the isolated H{sup −} anions by four Na{sup +} and two Mg{sup 2+} cations, which form layers between the transition metal containing layers. The vibrational modes of the H{sup −} anions and complex hydride anion are independently observed for the first time in a quaternary complex transition metal hydride system by Raman and IR spectroscopy.

High temperature-induced phase transitions in Sr{sub 2}GdRuO{sub 6} complex perovskite

Energy Technology Data Exchange (ETDEWEB)

Triana, C.A.; Corredor, L.T.; Landinez Tellez, D.A. [Grupo de Fisica de Nuevos Materiales, Departamento de Fisica, Universidad Nacional de Colombia, Bogota D.C. A.A. 14490 (Colombia); Roa-Rojas, J., E-mail: jroar@unal.edu.co [Grupo de Fisica de Nuevos Materiales, Departamento de Fisica, Universidad Nacional de Colombia, Bogota D.C. A.A. 14490 (Colombia)

2011-12-15

Highlights: Black-Right-Pointing-Pointer Crystal structure, thermal expansion and phase transitions at high-temperature of Sr{sub 2}GdRuO{sub 6} perovskite has been investigated. Black-Right-Pointing-Pointer X-ray diffraction pattern at 298 K of Sr{sub 2}GdRuO{sub 6} corresponds to monoclinic perovskite-type structure with P2{sub 1}/n space group. Black-Right-Pointing-Pointer Evolution of X-ray diffraction patterns at high-temperature shows that the Sr{sub 2}GdRuO{sub 6} perovskite suffers two-phase transitions. Black-Right-Pointing-Pointer At 573 K the X-ray diffraction pattern of Sr{sub 2}GdRuO{sub 6} corresponds to monoclinic perovskite-type structure with I2/m space group. Black-Right-Pointing-Pointer At 1273 K the Sr{sub 2}GdRuO{sub 6} perovskite suffers a complete phase-transition from monoclinic I2/m (no. 12) to tetragonal I4/m (no. 87). -- Abstract: The crystal structure behavior of the Sr{sub 2}GdRuO{sub 6} complex perovskite at high-temperature has been investigated over a wide temperature range between 298 K {<=} T {<=} 1273 K. Measurements of X-ray diffraction at room-temperature and Rietveld analysis of the experimental patterns show that this compound crystallizes in a monoclinic perovskite-like structure, which belongs to the P2{sub 1}/n (no. 14) space group and 1:1 ordered arrangement of Ru{sup 5+} and Gd{sup 3+} cations over the six-coordinate M sites. Experimental lattice parameters were obtained to be a =5.8103(5) Angstrom-Sign , b =5.8234(1) Angstrom-Sign , c =8.2193(9) Angstrom-Sign , V = 278.11(2) Angstrom-Sign {sup 3} and angle {beta} = 90.310(5) Degree-Sign . The high-temperature analysis shows the occurrence of two-phase transitions on this material. First, at 573 K it adopts a monoclinic perovskite-type structure with I2/m (no. 12) space group with lattice parameters a = 5.8275(6) Angstrom-Sign , b = 5.8326(3) Angstrom-Sign , c = 8.2449(2) Angstrom-Sign , V = 280.31(3) Angstrom-Sign {sup 3} and angle {beta} = 90.251(3) Degree-Sign . Close

Kinetic control in the synthesis of metastable polymorphs: Bixbyite-to-Rh{sub 2}O{sub 3}(II)-to-corundum transition in In{sub 2}O{sub 3}

Energy Technology Data Exchange (ETDEWEB)

Bekheet, Maged F., E-mail: maged.bekheet@ceramics.tu-berlin.de [Fachbereich Material -und Geowissenschaften, Technische Universität Darmstadt, Alarich-Weiss-Straße 2, 64287 Darmstadt (Germany); Fachgebiet Keramische Werkstoffe, Institut für Werkstoffwissenschaften und -technologien, Technische Universität Berlin, Hardenbergstraße 40, 10623 Berlin (Germany); Schwarz, Marcus R. [Freiberg High Pressure Research Centre, Institut für Anorganische Chemie, Technische Universität-Bergakademie Freiberg, Leipziger Straße 29, 09599 Freiberg (Germany); Kroll, Peter [Department of Chemistry and Biochemistry, The University of Texas at Arlington, Arlington, TX 760019-0065 (United States); Gurlo, Aleksander [Fachbereich Material -und Geowissenschaften, Technische Universität Darmstadt, Alarich-Weiss-Straße 2, 64287 Darmstadt (Germany); Fachgebiet Keramische Werkstoffe, Institut für Werkstoffwissenschaften und -technologien, Technische Universität Berlin, Hardenbergstraße 40, 10623 Berlin (Germany)

2015-09-15

An example for kinetic control of a solid-state phase transformation, in which the system evolves via the path with the lowest activation barrier rather than ending in the thermodynamically most favorable state, has been demonstrated. As a case study, the phase transitions of indium sesquioxide (In{sub 2}O{sub 3}) have been guided by theoretical calculations and followed in situ under high-pressure high-temperature conditions in multi-anvil assemblies. The corundum-type rh-In{sub 2}O{sub 3} has been synthesized from stable bixbyite-type c-In{sub 2}O{sub 3} in two steps: first generating orthorhombic Rh{sub 2}O{sub 3}-II-type o′-In{sub 2}O{sub 3} which is thermodynamically stable at 8.5 GPa/850 °C and, thereafter, exploiting the preferred kinetics in the subsequent transformation to the rh-In{sub 2}O{sub 3} during decompression. This synthesis strategy of rh-In{sub 2}O{sub 3} was confirmed ex situ in a toroid-type high-pressure apparatus at 8 GPa and 1100 °C. The pressure–temperature phase diagrams have been constructed and the stability fields of In{sub 2}O{sub 3} polymorphs and the crystallographic relationship between them have been discussed. - Graphical abstract: In situ energy-dispersive XRD patterns in multi-anvil assemblies show the sequence of phase transition c-In{sub 2}O{sub 3}→o′-In{sub 2}O{sub 3}→rh-In{sub 2}O{sub 3} under particular pressure and temperature conditions. The tick marks refer to the calculated Bragg positions of bixbyite-type (c-In{sub 2}O{sub 3}), Rh{sub 2}O{sub 3}-II-type (o–-In2O{sub 3}) and corundum-type (rh-In{sub 2}O{sub 3}). - Highlights: • The solid-state synthesis methods can be employed for obtaining metastable phases. • The phase transition of In{sub 2}O{sub 3} was guided by DFT calculations. • The phase transition of In{sub 2}O{sub 3} was followed in situ under HP–HT conditions. • Orthorhombic o′-In{sub 2}O{sub 3} polymorph was synthesized from c-In{sub 2}O{sub 3} at 8.5 GPa/850 °C. • Metastable rh-In{sub

Correlation of irradiation-induced transition temperature increases from C sub v and K sub Jc /K sub Ic data

Energy Technology Data Exchange (ETDEWEB)

Hiser, A.L. (Materials Engineering Associates, Inc., Lanham, MD (USA))

1990-03-01

Reactor pressure vessel (RPV) surveillance capsules contain Charpy-V (C{sub v}) specimens, but many do not contain fracture toughness specimens; accordingly, the radiation-induced shift (increase) in the brittle-to-ductile transition region ({Delta}T) is based upon the {Delta}T determined from notch ductility (C{sub v}) tests. Since the ASME K{sub Ic} and K{sub IR} reference fracture toughness curves are shifted by the {Delta}T from C{sub v}, assurance that this {Delta}T does not underestimate {Delta}T associated with the actual irradiated fracture toughness is required to provide confidence that safety margins do not fall below assumed levels. To assess this behavior, comparisons of {Delta}T's defined by elastic-plastic fracture toughness and C{sub v} tests have been made using data from RPV base and weld metals in which irradiations were made under test reactor conditions. Using as-measure'' fracture toughness values (K{sub Jc}), average comparisons between {Delta}T(C{sub v}) and {Delta}T(K{sub Jc}) are: (a) All data: {Delta}T(K{sub Jc} 100 MPa{radical}{bar m}) = {Delta}T(C{sub v} 41 J) +10{degree}C; (b) Plates only: {Delta}T(K{sub Jc} 100 MPa{radical}{bar m}) = {Delta}T(C{sub v} 41 J) +15{degree}C; and (c) Welds only: {Delta}T(K{sub Jc} 100 MPa{radical}{bar m}) = {Delta}T(C{sub v} 41 J) {minus}1{degree}C. Fluence rate is found to have no significant effect on the relationship between {Delta}T(C{sub v}) and {Delta}T(K{sub Jc}). 12 refs., 12 figs., 5 tabs.

Chiral phase transition of QCD with N{sub f}=2+1 flavors from holography

Energy Technology Data Exchange (ETDEWEB)

Li, Danning [Department of Physics, Jinan University,Guangzhou 510632 (China); Huang, Mei [Institute of High Energy Physics, Chinese Academy of Sciences,Beijing 100049 (China); University of Chinese Academy of Sciences,Beijing 100049 (China); Theoretical Physics Center for Science Facilities, Chinese Academy of Sciences,Beijing 100049 (China)

2017-02-08

Chiral phase transition for three-flavor N{sub f}=2+1 QCD with m{sub u}=m{sub d}≠m{sub s} is investigated in a modified soft-wall holographic QCD model. Solving temperature dependent chiral condensates from equations of motion of the modified soft-wall model, we extract the quark mass dependence of the order of chiral phase transition in the case of N{sub f}=2+1, and the result is in agreement with the “Columbia Plot”, which is summarized from lattice simulations and other non-perturbative methods. First order phase transition is observed around the three flavor chiral limit m{sub u/d}=0,m{sub s}=0, while at sufficient large quark masses it turns to be a crossover phase transition. The first order and crossover regions are separated by a second order phase transition line. The second order line is divided into two parts by the m{sub u/d}=m{sub s} line, and the m{sub s} dependence of the transition temperature in these two parts are totally contrast, which might indicate that the two parts are governed by different universality classes.

Absorption and luminescence characteristics of {sup 5}I{sub 7} ↔ {sup 5}I{sub 8} transitions of the holmium ion in Ho{sup 3+}-doped aluminosilicate preforms and fibres

Energy Technology Data Exchange (ETDEWEB)

Ryabochkina, P A; Chabushkin, A N [N.P. Ogarev Mordovian State University, Saransk (Russian Federation); Kosolapov, A F [Fiber Optics Research Center, Russian Academy of Sciences, Moscow (Russian Federation); Kurkov, A S [A M Prokhorov General Physics Institute, Russian Academy of Sciences, Moscow (Russian Federation)

2015-02-28

We have obtained the spectral dependences of the absorption cross sections for the Ho{sup 3+} {sup 5}I{sub 8} → {sup 5}I{sub 6} and {sup 5}I{sub 8} → {sup 5}I{sub 7} transitions in Ho{sup 3+}-doped aluminosilicate fibres and the spectral dependence of the stimulated emission cross section for the Ho{sup 3+} {sup 5}I{sub 7} → {sup 5}I{sub 8} laser transition in Ho{sup 3+}-doped aluminosilicate fibre preforms. The lifetime of the Ho{sup 3+} {sup 5}I{sub 7} upper laser level in the preforms has been determined. (lasers)

The pseudo-binary mercury chalcogenide alloy HgSe sub 0 sub . sub 7 S sub 0 sub . sub 3 at high pressure: a mechanism for the zinc blende to cinnabar reconstructive phase transition

CERN Document Server

Kozlenko, D P; Ehm, L; Hull, S; Savenko, B N; Shchennikov, V V; Voronin, V I

2003-01-01

The structure of the pseudo-binary mercury chalcogenide alloy HgSe sub 0 sub . sub 7 S sub 0 sub . sub 3 has been studied by x-ray and neutron powder diffraction at pressures up to 8.5 GPa. A phase transition from the cubic zinc blende structure to the hexagonal cinnabar structure was observed at P approx 1 GPa. A phenomenological model of this reconstructive phase transition based on a displacement mechanism is proposed. Analysis of the geometrical relationship between the zinc blende and the cinnabar phases has shown that the possible order parameter for the zinc blende-cinnabar structural transformation is the spontaneous strain e sub 4. This assignment agrees with the previously observed high pressure behaviour of the elastic constants of some mercury chalcogenides.

Pseudomonas aeruginosa ExoU augments neutrophil transepithelial migration.

Science.gov (United States)

Pazos, Michael A; Lanter, Bernard B; Yonker, Lael M; Eaton, Alex D; Pirzai, Waheed; Gronert, Karsten; Bonventre, Joseph V; Hurley, Bryan P

2017-08-01

Excessive neutrophil infiltration of the lungs is a common contributor to immune-related pathology in many pulmonary disease states. In response to pathogenic infection, airway epithelial cells produce hepoxilin A3 (HXA3), initiating neutrophil transepithelial migration. Migrated neutrophils amplify this recruitment by producing a secondary gradient of leukotriene B4 (LTB4). We sought to determine whether this two-step eicosanoid chemoattractant mechanism could be exploited by the pathogen Pseudomonas aeruginosa. ExoU, a P. aeruginosa cytotoxin, exhibits phospholipase A2 (PLA2) activity in eukaryotic hosts, an enzyme critical for generation of certain eicosanoids. Using in vitro and in vivo models of neutrophil transepithelial migration, we evaluated the impact of ExoU expression on eicosanoid generation and function. We conclude that ExoU, by virtue of its PLA2 activity, augments and compensates for endogenous host neutrophil cPLA2α function, leading to enhanced transepithelial migration. This suggests that ExoU expression in P. aeruginosa can circumvent immune regulation at key signaling checkpoints in the neutrophil, resulting in exacerbated neutrophil recruitment.

Pseudomonas aeruginosa ExoU augments neutrophil transepithelial migration.

Directory of Open Access Journals (Sweden)

Michael A Pazos

2017-08-01

Full Text Available Excessive neutrophil infiltration of the lungs is a common contributor to immune-related pathology in many pulmonary disease states. In response to pathogenic infection, airway epithelial cells produce hepoxilin A3 (HXA3, initiating neutrophil transepithelial migration. Migrated neutrophils amplify this recruitment by producing a secondary gradient of leukotriene B4 (LTB4. We sought to determine whether this two-step eicosanoid chemoattractant mechanism could be exploited by the pathogen Pseudomonas aeruginosa. ExoU, a P. aeruginosa cytotoxin, exhibits phospholipase A2 (PLA2 activity in eukaryotic hosts, an enzyme critical for generation of certain eicosanoids. Using in vitro and in vivo models of neutrophil transepithelial migration, we evaluated the impact of ExoU expression on eicosanoid generation and function. We conclude that ExoU, by virtue of its PLA2 activity, augments and compensates for endogenous host neutrophil cPLA2α function, leading to enhanced transepithelial migration. This suggests that ExoU expression in P. aeruginosa can circumvent immune regulation at key signaling checkpoints in the neutrophil, resulting in exacerbated neutrophil recruitment.

Pressure-induced phase transition in C sub 6 O sub 2 I sub 4

CERN Document Server

Nakayama, A; Takemura, K; Aoki, K; Carlon, R P

2002-01-01

Powder x-ray diffraction measurements on iodanil (C sub 6 O sub 2 I sub 4) have been carried out at pressures up to 39 GPa at room temperature with a diamond-anvil cell under the best hydrostatic conditions using helium as the pressure-transmitting medium. The diffraction patterns up to 23.3 GPa were fitted with a space group P 2 sub 1 /c. New peaks appeared above 26.8 GPa and their intensities increased with increasing pressure while the original ones observed for the low-pressure phase were gradually depressed. This phase transition was accompanied with a mixed state of low- and high-pressure phases over the wide pressure range between 26.8 and at least 39 GPa.

On the nature of phase transitions in the tetragonal tungsten bronze GdK{sub 2}Nb{sub 5}O{sub 15} ceramics

Energy Technology Data Exchange (ETDEWEB)

Gagou, Y.; Lukyanchuk, I.; El Marssi, M., E-mail: mimoun.elmarssi@u-picardie.fr [Laboratoire de Physique de la Matière Condensée, Université de Picardie Jules Verne, 33 rue Saint-Leu, 80039 Amiens Cedex (France); Amira, Y. [Laboratoire de Physique de la Matière Condensée, Université de Picardie Jules Verne, 33 rue Saint-Leu, 80039 Amiens Cedex (France); Laboratoire de la Matière Condensée et Nanostructures, FSTG, Université Cadi Ayyad Marrakech, Maroc (Morocco); Mezzane, D. [Laboratoire de la Matière Condensée et Nanostructures, FSTG, Université Cadi Ayyad Marrakech, Maroc (Morocco); Courty, M.; Masquelier, C. [Laboratoire de Réactivité et Chimie des Solides, UMR 7314, Université de Picardie Jules Verne, Pôle Scientifique, 33 rue Saint-Leu, 80039 Amiens Cedex 1 (France); Yuzyuk, Yu. I. [Faculty of Physics, Southern Federal University, 5, Zorge Str. Rostov-on-Don 344090 (Russian Federation)

2014-02-14

Phase transitions in gadolinium potassium niobate GdK{sub 2}Nb{sub 5}O{sub 15} (GKN) ceramics have been investigated by x-ray diffraction, dielectric susceptibility, differential scanning calorimetry, and Raman scattering. The results of our complementary studies show that GKN exhibits two phase transitions at T{sub c1} = 238 °C and T{sub c2} = 375 °C attributed to the ferroelectric-antiferroelectric-paraelectric (FE-AFE-PE) phase transitions. According to the x-ray diffraction analysis, the FE and PE phases were refined in the polar P4bm and centrosymmetric P4/mbm space groups. For the intermediate phase, the structure is refined in the space group P4nc with doubling of the c unit cell parameter, which is compatible with an AFE phase. This result was confirmed by Raman spectroscopy since new low-frequency lines are activated in the AFE phase due to the Brillouin zone-folding effect, typical for the modulated phases. The presence of the AFE phase between the FE and PE phases and the complex nature of tetragonal tungsten bronze crystal structure can explain the large thermal hysteresis observed at the FE-AFE transition between heating and cooling cycle and the strong depression of the Curie-Weiss temperature T{sub 0}. The semi-phenomenological Ising-like model based on the obtained experimental data is proposed to account for the observed FE-AFE-PE transition sequence.

Investigation of radioactivity-induced backgrounds in EXO-200

Energy Technology Data Exchange (ETDEWEB)

Albert, J. B.; Auty, D. J.; Barbeau, P. S.; Beck, D.; Belov, V.; Benitez-Medina, C.; Breidenbach, M.; Brunner, T.; Burenkov, A.; Cao, G. F.; Chambers, C.; Cleveland, B.; Coon, M.; Craycraft, A.; Daniels, T.; Danilov, M.; Daugherty, S. J.; Davis, C. G.; Davis, J.; Delaquis, S.; Der Mesrobian-Kabakian, A.; DeVoe, R.; Didberidze, T.; Dolgolenko, A.; Dolinski, M. J.; Dunford, M.; Fairbank, W.; Farine, J.; Feldmeier, W.; Fierlinger, P.; Fudenberg, D.; Giroux, G.; Gornea, R.; Graham, K.; Gratta, G.; Hall, C.; Herrin, S.; Hughes, M.; Jewell, M. J.; Jiang, X. S.; Johnson, A.; Johnson, T. N.; Johnston, S.; Karelin, A.; Kaufman, L. J.; Killick, R.; Koffas, T.; Kravitz, S.; Kuchenkov, A.; Kumar, K. S.; Leonard, D. S.; Licciardi, C.; Lin, Y. H.; Ling, J.; MacLellan, R.; Marino, M. G.; Mong, B.; Moore, D.; Nelson, R.; Odian, A.; Ostrovskiy, I.; Piepke, A.; Pocar, A.; Prescott, C. Y.; Rivas, A.; Rowson, P. C.; Russell, J. J.; Schubert, A.; Sinclair, D.; Smith, E.; Stekhanov, V.; Tarka, M.; Tolba, T.; Tsang, R.; Twelker, K.; Vuilleumier, J. -L.; Waite, A.; Walton, J.; Walton, T.; Weber, M.; Wen, L. J.; Wichoski, U.; Wood, J.; Yang, L.; Yen, Y. -R.; Zeldovich, O. Ya.

2015-07-15

The search for neutrinoless double-beta decay ( 0 ν β β ) requires extremely low background and a good understanding of their sources and their influence on the rate in the region of parameter space relevant to the 0 ν β β signal. We report on studies of various β and γ backgrounds in the liquid-xenon-based EXO- 200 0 ν β β experiment. With this work we try to better understand the location and strength of specific background sources and compare the conclusions to radioassay results taken before and during detector construction. Finally, we discuss the implications of these studies for EXO-200 as well as for the next-generation, tonne-scale nEXO detector.

EXO70C2 is a key regulatory factor for optimal tip growth of pollen

KAUST Repository

Synek, Lukas

2017-03-30

The exocyst, an eukaryotic tethering complex, co-regulates targeted exocytosis as an effector of small GTPases in polarized cell growth. In land plants, several exocyst subunits are encoded by double or triple paralogs, culminating in tens of EXO70 paralogs. Out of 23 Arabidopsis EXO70 isoforms, we analyzed seven isoforms expressed in pollen. Genetic and microscopic analyses of single mutants in EXO70A2, C1, C2, F1, H3, H5, and H6 genes revealed that only a loss-of-function EXO70C2 allele resulted in a significant male-specific transmission defect (segregation 40%:51%:9%) due to aberrant pollen tube growth. Mutant pollen tubes grown in vitro exhibited enhanced growth rate and a decreased thickness of the tip cell wall, causing tip bursts. However, exo70C2 pollen tubes could frequently recover and restart their speedy elongation, resulting in a repetitive stop-and-go growth dynamics. A pollen-specific depletion of the closest paralog, EXO70C1, using ami-RNA in the exo70C2 mutant background resulted in a complete pollen-specific transmission defect, suggesting redundant functions of EXO70C1 and EXO70C2. Both EXO70C1 and EXO70C2, GFP-tagged and expressed under their native promoters, localized in the cytoplasm of pollen grains, pollen tubes, and also root trichoblast cells. Expression of EXO70C2-GFP complemented aberrant growth of exo70C2 pollen tubes. The absent EXO70C2 interactions with core exocyst subunits in the yeast two-hybrid assay, cytoplasmic localization, and genetic effect suggest an unconventional EXO70 function possibly as a regulator of exocytosis outside the exocyst complex. In conclusion, EXO70C2 is a novel factor contributing to the regulation of optimal tip growth of Arabidopsis pollen tubes.

Electric field-induced phase transitions in Li-modified Na{sub 0.5}K{sub 0.5}NbO{sub 3} at the polymorphic phase boundary

Energy Technology Data Exchange (ETDEWEB)

Iamsasri, Thanakorn; Jones, Jacob L., E-mail: jacobjones@ncsu.edu [Department of Materials Science and Engineering, North Carolina State University, Raleigh, North Carolina 27695 (United States); Department of Materials Science and Engineering, University of Florida, Gainesville, Florida 32611 (United States); Tutuncu, Goknur [Department of Materials Science and Engineering, University of Florida, Gainesville, Florida 32611 (United States); Uthaisar, Chunmanus; Pojprapai, Soodkhet [School of Ceramic Engineering, Institute of Engineering, Suranaree University of Technology, Nakorn Ratchasima 30000 (Thailand); Wongsaenmai, Supattra [Program in Materials Science, Faculty of Science, Maejo University, Chiang Mai 50290 (Thailand)

2015-01-14

The electric field-induced phase transitions in Li-modified Na{sub 0.5}K{sub 0.5}NbO{sub 3} at the polymorphic phase boundary (PPB) were observed using in situ X-ray diffraction. The ratio of monoclinic to tetragonal phase fraction was used as an indicator of the extent and reversibility of the phase transitions. The reversibility of the phase transition was greater in compositions further from the PPB. These results demonstrate that the field-induced phase transition is one of the origins of high piezoelectric properties in lead-free ferroelectric materials.

Effects of dopants on the amorphous-to-fcc transition in Ge{sub 2}Sb{sub 2}Te{sub 5} thin films

Energy Technology Data Exchange (ETDEWEB)

Privitera, S. [R and D Department, Micro, Power, Analog (MPA) Group, STMicroelectronics, MP8, Stradale Primosole 50, 95121 Catania (Italy)]. E-mail: stefania.privitera@st.com; Rimini, E. [Istituto di Microelettronica e Microsistemi (IMM), Consiglio Nazionale delle Ricerche (CNR), Stradale Primosole 50, 95121 Catania (Italy); Bongiorno, C. [Istituto di Microelettronica e Microsistemi (IMM), Consiglio Nazionale delle Ricerche (CNR), Stradale Primosole 50, 95121 Catania (Italy); Pirovano, A. [FTM, Advanced R and D, NVMTD, STMicroelectronics, Via Olivetti 2, 20041, Agrate Brianza (Italy); Bez, R. [FTM, Advanced R and D, NVMTD, STMicroelectronics, Via Olivetti 2, 20041, Agrate Brianza (Italy)

2007-04-15

The amorphous-to-crystal transition has been studied through in situ resistance measurements in Ge{sub 2}Sb{sub 2}Te{sub 5} thin films doped by ion implantation with nitrogen, oxygen or fluorine at different concentrations. Enhancement of the thermal stability has been observed in O and N amorphous doped Ge{sub 2}Sb{sub 2}Te{sub 5}. Larger effects have been found in the case of nitrogen doping. On the contrary, doping with Fluorine produced a decrease in the crystallization temperature. The electrical properties have been related to the structural phase change through in situ transmission electron microscopy analysis. The comparison between undoped and doped Ge{sub 2}Sb{sub 2}Te{sub 5} shows that the introduction of oxygen or nitrogen modifies in a different way the kinetics of the amorphous-to-fcc transition and gives new insight on the effects of doping with light elements in GeSbTe alloys.

Exo-exo synergy between Cel6A and Cel7A from Hypocrea jecorina: Role of carbohydrate binding module and the endo-lytic character of the enzymes.

Science.gov (United States)

Badino, Silke F; Christensen, Stefan J; Kari, Jeppe; Windahl, Michael S; Hvidt, Søren; Borch, Kim; Westh, Peter

2017-08-01

Synergy between cellulolytic enzymes is essential in both natural and industrial breakdown of biomass. In addition to synergy between endo- and exo-lytic enzymes, a lesser known but equally conspicuous synergy occurs among exo-acting, processive cellobiohydrolases (CBHs) such as Cel7A and Cel6A from Hypocrea jecorina. We studied this system using microcrystalline cellulose as substrate and found a degree of synergy between 1.3 and 2.2 depending on the experimental conditions. Synergy between enzyme variants without the carbohydrate binding module (CBM) and its linker was strongly reduced compared to the wild types. One plausible interpretation of this is that exo-exo synergy depends on the targeting role of the CBM. Many earlier works have proposed that exo-exo synergy was caused by an auxiliary endo-lytic activity of Cel6A. However, biochemical data from different assays suggested that the endo-lytic activity of both Cel6A and Cel7A were 10 3 -10 4 times lower than the common endoglucanase, Cel7B, from the same organism. Moreover, the endo-lytic activity of Cel7A was 2-3-fold higher than for Cel6A, and we suggest that endo-like activity of Cel6A cannot be the main cause for the observed synergy. Rather, we suggest the exo-exo synergy found here depends on different specificities of the enzymes possibly governed by their CBMs. Biotechnol. Bioeng. 2017;114: 1639-1647. © 2017 Wiley Periodicals, Inc. © 2017 Wiley Periodicals, Inc.

Excited states of hypernuclei (populated by low energetic separated K- beam)

CERN Document Server

Bamberger, A; Haddock, R; Lynen, U; Moszkowski, S; Piekarz, H; Piekarz, J; Pniewski, J; Povh, B; Ritter, H G; Soergel, Volker; Van Oers, W T H

1972-01-01

The experimental investigation of hypernuclei up to now has been done using emulsions and bubble chambers and therefore, with only 2 exemptions, all existing knowledge concerns hypernuclear ground states. The investigation of excited states in general is only possible using counter techniques, but these experiments could not be performed due to the low intensity of available K/sup -/-beams. At CERN a low energetic separated K-beam has been built, at which 1000 K /sup -/-mesons per burst can be stopped in a target of 6g/cm/sup 2/ thickness. At this beam an experiment looking for gamma -transitions in excited hypernuclei has been performed. In order to eliminate background gamma -radiation arising from kappa /sup -/ annihilation and de-excitation of residual nuclei, only light targets were used, namely /sup 6/Li, /sup 7/Li, /sup 9/Be, /sup 12/C and /sup 16/O. Hypernuclear transitions were found in /sup 4//sub Lambda /H and /sup 4//sub Lambda /He and possible transitions in /sup 6/Li and /sup 7/Li. The scatterin...

THE CONDITION AND THE DYNAMICS OF CHANGES OF REGIONAL ENERGETIC SAFETY LEVEL

Directory of Open Access Journals (Sweden)

A.L. Myzin

2006-12-01

Full Text Available On the basis of indicative analysis method use, the dynamic processes of changes of energetic safety condition of federal districts and subjects of Russian Federation for last 5 years are investigated. The results of diagnosing safety levels for separate indicators, their blocks and the results of situation evaluation as a whole are discussed. The comparison of regions’ energetic safety condition is given, the causes of crisis situations appearance are discovered, and on this basis the suggestions for regions’ safety levels increasing are formulated.

21 CFR 866.3720 - Streptococcus spp. exo-enzyme reagents.

Science.gov (United States)

2010-04-01

... 21 Food and Drugs 8 2010-04-01 2010-04-01 false Streptococcus spp. exo-enzyme reagents. 866.3720... (CONTINUED) MEDICAL DEVICES IMMUNOLOGY AND MICROBIOLOGY DEVICES Serological Reagents § 866.3720 Streptococcus spp. exo-enzyme reagents. (a) Identification. Streptococcus spp. exoenzyme reagents are devices used...

ExoGeoLab Pilot Project for Landers, Rovers and Instruments

Science.gov (United States)

Foing, Bernard

2010-05-01

We have developed a pilot facility with a Robotic Test Bench (ExoGeoLab) and a Mobile Lab Habitat (ExoHab). They can be used to validate concepts and external instruments from partner institutes. The ExoGeoLab research incubator project, has started in the frame of a collaboration between ILEWG (International Lunar Exploration working Group http://sci.esa.int/ilewg), ESTEC, NASA and academic partners, supported by a design and control desk in the European Space Incubator (ESI), as well as infrastructure. ExoGeoLab includes a sequence of technology and research pilot project activities: - Data analysis and interpretation of remote sensing and in-situ data, and merging of multi-scale data sets - Procurement and integration of geophysical, geo-chemical and astrobiological breadboard instruments on a surface station and rovers - Integration of cameras, environment and solar sensors, Visible and near IR spectrometer, Raman spectrometer, sample handling, cooperative rovers - Delivery of a generic small planetary lander demonstrator (ExoGeoLab lander, Sept 2009) as a platform for multi-instruments tests - Research operations and exploitation of ExoGeoLab test bench for various conceptual configurations, and support for definition and design of science surface packages (Moon, Mars, NEOs, outer moons) - Field tests of lander, rovers and instruments in analogue sites (Utah MDRS 2009 & 2010, Eifel volcanic park in Sept 2009, and future campaigns). Co-authors, ILEWG ExoGeoLab & ExoHab Team: B.H. Foing(1,11)*#, C. Stoker(2,11)*, P. Ehrenfreund(10,11), L. Boche-Sauvan(1,11)*, L. Wendt(8)*, C. Gross(8, 11)*, C. Thiel(9)*, S. Peters(1,6)*, A. Borst(1,6)*, J. Zavaleta(2)*, P. Sarrazin(2)*, D. Blake(2), J. Page(1,4,11), V. Pletser(5,11)*, E. Monaghan(1)*, P. Mahapatra(1)#, A. Noroozi(3), P. Giannopoulos(1,11) , A. Calzada(1,6,11), R. Walker(7), T. Zegers(1, 15) #, G. Groemer(12)# , W. Stumptner(12)#, B. Foing(2,5), J. K. Blom(3)#, A. Perrin(14)#, M. Mikolajczak(14)#, S. Chevrier(14

Synthesis of Mg{sub 2}FeH{sub 6} containing as additives transition metal and transition metal fluorides or carbon; Sintese de Mg{sub 2}FeH{sub 6} contando como aditivos metais de transicao e fluoretos de metais de transicao ou carbono

Energy Technology Data Exchange (ETDEWEB)

Zepon, G.; Leiva, D.R.; Botta, W.J., E-mail: guizepon@yahoo.com.b [Universidade Federal de Sao Carlos (DEMa/UFSCar), SP (Brazil). Dept. de Engenharia de Materiais

2010-07-01

The Mg{sub 2}FeH{sub 6} is a promising way of storing hydrogen in solid form, composed by elements that have low cost and, at the same time, high volumetric storage density: 150 kg H{sub 2}/m{sup 3}. However, this complex hydride is not easily synthesized as a single phase material. The hydrogen sorption high temperature and slow kinetics are the major limitations for the practical application of the Mg{sub 2}FeH{sub 6} as a hydrogen storage material. Little is known about the effects of additives in Mg{sub 2}FeH{sub 6} based nanocomposites in this work were synthesized by MAE under hydrogen atmosphere nanocomposites based on Mg{sub 2}FeH{sub 6} containing additives as transition metals, transition metals fluorides of transition metals or carbon, in order to obtain information on the effects of the selected additives. To this end, we used characterization techniques such as XRD, SEM and TEM, thermal analysis by DSC and curves made in apparatus PCT.(author)

Phase transitions in Fe{sub 0.5}Co{sub 0.5} (110) thin films

Energy Technology Data Exchange (ETDEWEB)

Ramírez-Dámaso, G., E-mail: gramirezd@ipn.mx [Escuela Superior de Ingeniería y Arquitectura “Unidad Ticomán” del Instituto Politécnico Nacional, Av. Ticomán No. 600, Col. San José Ticomán, Del. G. A. M., C. P. 07330 Ciudad de México (Mexico); Castillo-Alvarado, F.L. [Escuela Superior de Física y Matemáticas del Instituto Politécnico Nacional, Edificio 9, Col. San Pedro Zacatenco, C. P. 07738 Ciudad de México (Mexico); Rojas-Hernández, E. [Escuela Superior de Ingeniería y Arquitectura “Unidad Ticomán” del Instituto Politécnico Nacional, Av. Ticomán No. 600, Col. San José Ticomán, Del. G. A. M., C. P. 07330 Ciudad de México (Mexico)

2016-12-15

In this paper, we present calculations for two second-order phase transitions in (110) Fe{sub 0.5}Co{sub 0.5} thin films with 11, 15, and 19 monoatomic layers. The lattice and magnetic transitions are based on thermodynamic equilibrium considerations of the magnetic alloy. The procedure proposed by Valenta and Sukiennicki was applied to calculate the composition x(i), the lattice order parameter t(i), and the magnetic order parameter σ(i) as a function of temperature T. We confirmed that both phase transitions, lattice and magnetic, are of the second order, in accordance with experimental results in the literature. The obtained behavior of these parameters indicates their inhomogeneity due to the boundary conditions on the surfaces of the thin film.

Human exonuclease 1 (EXO1) activity characterization and its function on FLAP structures

DEFF Research Database (Denmark)

Keijzers, Guido; Bohr, Vilhelm A; Juel Rasmussen, Lene

2015-01-01

structures, we determined factors essential for the thermodynamic stability of EXO1. We show that enzymatic activity and stability of EXO1 on DNA is modulated by temperature. By characterization of EXO1 flap activity using various DNA flap substrates, we show that EXO1 has a strong capacity for degrading...... double stranded DNA and has a modest endonuclease or 5' flap activity. Furthermore, we report novel mechanistic insights into the processing of flap structures, showing that EXO1 preferentially cleaves one nucleotide inwards in a double stranded region of a forked and nicked DNA flap substrates...

Sub-Poissonian statistics in order-to-chaos transition

International Nuclear Information System (INIS)

Kryuchkyan, Gagik Yu.; Manvelyan, Suren B.

2003-01-01

We study the phenomena at the overlap of quantum chaos and nonclassical statistics for the time-dependent model of nonlinear oscillator. It is shown in the framework of Mandel Q parameter and Wigner function that the statistics of oscillatory excitation numbers is drastically changed in the order-to-chaos transition. The essential improvement of sub-Poissonian statistics in comparison with an analogous one for the standard model of driven anharmonic oscillator is observed for the regular operational regime. It is shown that in the chaotic regime, the system exhibits the range of sub-Poissonian and super-Poissonian statistics which alternate one to other depending on time intervals. Unusual dependence of the variance of oscillatory number on the external noise level for the chaotic dynamics is observed. The scaling invariance of the quantum statistics is demonstrated and its relation to dissipation and decoherence is studied

Quantum-chemical ab initio calculations on the three isomers of diborabenzene (C{sub 4}H{sub 4}B{sub 2})

Energy Technology Data Exchange (ETDEWEB)

Singh, Jaswinder; Raabe, Gerhard [Inst. fuer Organische Chemie, RWTH Aachen Univ. (Germany); Wang Yuekui [Key Lab. of Chemical Biology and Molecular Engineering of the Education Ministry, Inst. of Molecular Science, Shanxi Univ., Taiyuan, SH (China)

2010-01-15

Quantum-chemical ab initio calculations up to the ZPE+CCSD(T)/aug-cc-pVTZ/MP2/6-311++G** level were performed on three possible structural isomers of diborabenzene (C{sub 4}H{sub 4}B{sub 2}). All three molecules were found to be local minima on the C{sub 4}H{sub 4}B{sub 2} energy surface and to have closed shell singlet ground states. While the ground states of the 1,3- and 1,4-isomer are planar and of C{sub 2v} and D{sub 2h} symmetry, respectively, 1,2-diborabenzene is non-planar with a C{sub 2} axis passing through the center of the BB bond and the middle of the opposite carbon-carbon bond as the only symmetry element. The energetically most favourable 1,3-diborabenzene was found to be about 19 and 36 kcal/mol lower in energy than the 1,2- and the 1,4-isomer. Planar 1,3- and 1,4-diborabenzene have three doubly occupied {pi} orbitals while non-planar 1,2-diborabenzene has also three doubly occupied orbitals which can be derived from the {pi} orbitals of its 3.7 kcal/mol energetically less favourable planar form (''{pi}=like'' orbitals). The lowest unoccupied orbitals of all three isomers have {sigma} symmetry with large coefficients at the two boron atoms. These orbitals are lower in energy than the lowest unoccupied molecular orbitals (LUMOs) of e. g. benzene and pyridine and might cause pronounced acceptor properties which could be one of the reasons for the elusiveness of the title compounds. The results of bond separation reactions show that cyclic conjugation stabilizes all three diborabenzenes relative to their isolated fragments. The most effective stabilization energy of about 24 kcal/mol was found for the energetically lowest 1,3-isomer. This value amounts to approximately one third of the experimental value for the bond separation energy of pyridine. In all cases the energetically lowest triplet states are significantly (16 - 24 kcal/mol) higher in energy than the singlet ground states. Also among the triplets the 1,3-isomer is the

Transition from weak ferromagnetism to metamagnetism in the itinerant-electron system Y{sub 1-x}La{sub x}Co{sub 9}Si{sub 4}

Energy Technology Data Exchange (ETDEWEB)

Nishiyama, M; Kohara, T [Graduate School of Material Science, University of Hyogo, Kamigori, Ako-gun, Hyogo 678-1297 (Japan); Nakamura, H [Department of Materials Science and Engineering, Kyoto University, Kyoto 606-8501 (Japan)

2010-01-15

The magnetism of solid solution Yi{sub 1-x}La{sub x}Co{sub 9}Si{sub 4} between strongly enhanced Pauli paramagnetic LaCo{sub 9}Si{sub 4} and weakly ferromagnetic YCo{sub 9}Si{sub 4} has been investigated. The Curie temperature T{sub C} in the ferromagnetic region and the metamagnetic transition field H{sub M} in the paramagnetic region change continuously against x and approach zero at the same composition x {approx_equal} 0.15, suggesting the presence of a critical point from spontaneous to field-induced ferromagnetism.

Interplay of catalysis, fidelity, threading, and processivity in the exo- and endonucleolytic reactions of human exonuclease I

Energy Technology Data Exchange (ETDEWEB)

Shi, Yuqian; Hellinga, Homme W.; Beese, Lorena S. (Duke-MED)

2017-05-22

Human exonuclease 1 (hExo1) is a member of the RAD2/XPG structure-specific 5'-nuclease superfamily. Its dominant, processive 5'–3' exonuclease and secondary 5'-flap endonuclease activities participate in various DNA repair, recombination, and replication processes. A single active site processes both recessed ends and 5'-flap substrates. By initiating enzyme reactions in crystals, we have trapped hExo1 reaction intermediates that reveal structures of these substrates before and after their exo- and endonucleolytic cleavage, as well as structures of uncleaved, unthreaded, and partially threaded 5' flaps. Their distinctive 5' ends are accommodated by a small, mobile arch in the active site that binds recessed ends at its base and threads 5' flaps through a narrow aperture within its interior. A sequence of successive, interlocking conformational changes guides the two substrate types into a shared reaction mechanism that catalyzes their cleavage by an elaborated variant of the two-metal, in-line hydrolysis mechanism. Coupling of substrate-dependent arch motions to transition-state stabilization suppresses inappropriate or premature cleavage, enhancing processing fidelity. The striking reduction in flap conformational entropy is catalyzed, in part, by arch motions and transient binding interactions between the flap and unprocessed DNA strand. At the end of the observed reaction sequence, hExo1 resets without relinquishing DNA binding, suggesting a structural basis for its processivity.

High pressure phase transitions in Mg{sub 1-x}Ca{sub x}O: Theory

Energy Technology Data Exchange (ETDEWEB)

Srivastava, Anurag; Chauhan, Mamta [Advanced Material Research Lab, Indian Institute of Information Technology and Management, Gwalior (India); Singh, R.K. [Department of Physics, ITM University, Gurgaon (India); Padegaonker, Rishikesh [Indian Embassy School, Sana (Yemen)

2011-08-15

We have analysed a B1 {yields} B2 structural phase transitions in Mg{sub 1-x}Ca{sub x}O solid solutions and their ground state properties by using first principle density functional theory and charge transfer interaction potential (CTIP) approach. The effects of exchange-correlation interactions are handled by the generalized gradient approximation with Perdew-Burke-Ernzerhof type parameterization. CTIP approach includes the long range modified Coulomb with charge transfer interactions and short range part of this model includes the van der Waals as well as Hafemeister Flygare type overlap repulsive interactions. The study observes a linear variation of calculated transition pressure, bulk modulus and lattice parameter of Mg{sub 1-x}Ca{sub x}O as a function of Ca composition. The observed results for the end point members are in agreement to their experimental counterparts and the deviations have been discussed. (Copyright copyright 2011 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

Optimal conditions to use Pfu exo(-) DNA polymerase for highly efficient ligation-mediated polymerase chain reaction protocols.

Science.gov (United States)

Angers, M; Cloutier, J F; Castonguay, A; Drouin, R

2001-08-15

Ligation-Mediated Polymerase Chain Reaction (LMPCR) is the most sensitive sequencing technique available to map single-stranded DNA breaks at the nucleotide level of resolution using genomic DNA. LMPCR has been adapted to map DNA damage and reveal DNA-protein interactions inside living cells. However, the sequence context (GC content), the global break frequency and the current combination of DNA polymerases used in LMPCR affect the quality of the results. In this study, we developed and optimized an LMPCR protocol adapted for Pyrococcus furiosus exo(-) DNA polymerase (Pfu exo(-)). The relative efficiency of Pfu exo(-) was compared to T7-modified DNA polymerase (Sequenase 2.0) at the primer extension step and to Thermus aquaticus DNA polymerase (Taq) at the PCR amplification step of LMPCR. At all break frequencies tested, Pfu exo(-) proved to be more efficient than Sequenase 2.0. During both primer extension and PCR amplification steps, the ratio of DNA molecules per unit of DNA polymerase was the main determinant of the efficiency of Pfu exo(-), while the efficiency of Taq was less affected by this ratio. Substitution of NaCl for KCl in the PCR reaction buffer of Taq strikingly improved the efficiency of the DNA polymerase. Pfu exo(-) was clearly more efficient than Taq to specifically amplify extremely GC-rich genomic DNA sequences. Our results show that a combination of Pfu exo(-) at the primer extension step and Taq at the PCR amplification step is ideal for in vivo DNA analysis and DNA damage mapping using LMPCR.

Phase-glass scaling near the coherence transition in granular HoBa{sub 2}Cu{sub 3}O{sub 7-{delta}} superconducting thin films

Energy Technology Data Exchange (ETDEWEB)

Roa-Rojas, J.; Landinez Tellez, D.A. [Grupo de Fisica de Nuevos Materiales, Departamento de Fisica, Universidad Nacional de Colombia, A. A. 14490, Bogota DC (Colombia); Prieto, P. [Grupo de Peliculas Delgadas, Departamento de Fisica, Universidad del Valle, A. A. 25360, Cali (Colombia)

2005-07-01

Systematic measurements of electrical magnetoconductivity near the coherence transition of granular HoBa{sub 2}Cu{sub 3}O{sub 7-{delta}} thin films are reported. Experiments performed in magnetic fields ranging from 0 to 2500 Oe reveal that close to the coherence transition temperature T{sub c0}(H), the correlation length scales as a power law of temperature with a thermal-dependent critical exponent, {nu}. In low external fields the corresponding value of {nu} is consistent with the two-dimensional phase-glass model, which is in the same dynamical universality class of the so-called vortex-glass model. At applied fields H > 1000 Oe, the vortex dynamics becomes stronger and the coherence transition is not observed. (copyright 2005 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

Calculation of parity violating effects in the 62P/sub 1/2/-72P/sub 1/2/ forbidden M1 transition in thallium

International Nuclear Information System (INIS)

Neuffer, D.B.

1977-05-01

Calculations are presented of the E1 amplitude expected in forbidden M1 transitions of Tl and Cs if parity is violated in the neutral weak e-N interaction, as proposed in a number of gauge models, including that of Weinberg and Salam. Valence electron wave functions are generated as numerical solutions to the Dirac equation in a modified Tietz central potential. These wave functions are used to calculate allowed E1 transition rates, hfs splittings, and Stark E1 transition ampitudes. These results are compared with experiment and the agreement is generally good. The relativistic Tl 6 2 P/sub 1/2/-7 2 P/sub 1/2/ M1 transition amplitude M is also calculated, and corrections due to interconfiguration interaction, Breit interaction, and hfs mixing are included. The parity violating E1 amplitude E/sub PV/ is calculated and a value for the circular dichroism in the Weinberg model delta = -2.6 x 10 -3 is obtained. Parity violating effects in other Tl transitions are discussed. Contributions to the M1 amplitude for the forbidden Cs 6 2 S/sub 1/2/-7 2 S/sub 1/2/ and 6 2 S/sub 1/2/-8 2 S/sub 1/2/ transitions and to the Cs 6 2 S/sub 1/2/ g-factor anomaly from relativistic effects, Breit interaction, interconfiguration interaction, and hfs mixing are calculated, and it is found that this current theoretical description is not entirely adequate. The parity violating E1 amplitude E/sub PV/ for the 6S/sub 1/2/-7 2 S/sub 1/2/ and 6S/sub 1/2/-8 2 S/sub 1/2/ transitions is evaluated. With a measured value M/sub expt/ and the Weinberg value Q/sub W/ = -99, a circular dichroism delta = 1.64 x 10 -4 for the 6 2 S/sub 1/2/-7 2 S/sub 1/2/ transition is found

Piezoelectric properties and diffusion phase transition around PPT of La-doped (Na{sub 0.52}K{sub 0.44}Li{sub 0.04}) Nb{sub 0.8}Ta{sub 0.2}O{sub 3} lead-free piezoelectric ceramics

Energy Technology Data Exchange (ETDEWEB)

Yang, Wenlong, E-mail: yangwenlong1983@163.com; Wang, Li; Li, Haidong; Han, Junsheng; Xiu, Hanjiang; Zhou, Zhongxiang

2016-10-01

Lead-free ceramics (Na{sub 0.52}K{sub 0.44}Li{sub 0.04}){sub 1−3x}La{sub x}Nb{sub 0.8}Ta{sub 0.2}O{sub 3} (KNLNT-Lax, x=0.00, 0.25, 0.5, 0.75, 1.00, 1.25 mol%) as non-polluting materials were prepared by solid state reaction method. The structure, piezoelectric proprieties and temperature stability of KNLNT ceramic with different La doping concentrations were investigated. The results show a transition from orthorhombic-tetragonal mix phase to tetragonal single phase with the variation of La{sup 3+} concentrations. The SEM micrographs of surface and fractured surface show a dense microstructure with few micropores. The La-doped KNLTN ceramic will be an alternative candidate contributes to excellent piezoelectric properties, which are found in the 0.75 mol% La-doped KNLNT ceramics, with d{sub 33}=215pC/N, k{sub p}=42.8%and Q{sub m}=89. It has been remarkably improved that the temperature stability of KNLTN-Lax piezoelectric properties at room temperature, and the dielectric relaxation can be observed obviously. The mechanism of La doping was analyzed in terms of valence compensation and polymorphic phase transition (PPT) diffusion. The orthorhombic-tetragonal phase transition around room temperature and the relaxation transition were considered contributing to the excellent piezoelectric performance and improved temperature stability of La{sup 3+}-doped KNLTN.

Mott transition in Ga-doped Mg{sub x}Zn{sub 1-x}O: A direct observation

Energy Technology Data Exchange (ETDEWEB)

Wei Wei; Nori, Sudhakar [Department of Materials Science and Engineering, North Carolina State University, Raleigh, NC (United States); Jin Chunming [Department of Biomedical Engineering, University of North Carolina and North Carolina State University, Campus Box 7115, Raleigh, NC 27695-7115 (United States); Narayan, Jagdish [Department of Materials Science and Engineering, North Carolina State University, Raleigh, NC (United States); Narayan, Roger J., E-mail: roger_narayan@unc.edu [Department of Biomedical Engineering, University of North Carolina and North Carolina State University, Campus Box 7115, Raleigh, NC 27695-7115 (United States); Ponarin, Dmtri; Smirnov, Alex [Department of Chemistry, North Carolina State University, Raleigh, NC (United States)

2010-07-25

This paper reports the direct evidence for Mott transition in Ga-doped Mg{sub x}Zn{sub 1-x}O thin films. Highly transparent Ga-doped Mg{sub x}Zn{sub 1-x}O thin films were grown on c-plane sapphire substrates using pulsed laser deposition. 0.1 at.%, 0.5 at.% and 1 at.% Ga-doped Mg{sub 0.1}Zn{sub 0.9}O films were selected for resistivity measurements in the temperature range from 250 K to 40 mK. The 0.1 at.% Ga-doped Mg{sub 0.1}Zn{sub 0.9}O thin film showed typical insulator-like behavior and the 1 at.% Ga-doped Mg{sub 0.1}Zn{sub 0.9}O thin film showed typical metal-like behavior. The 0.5 at.% Ga-doped Mg{sub 0.1}Zn{sub 0.9}O film showed increasing resistivity with decreasing temperature; resistivity was saturated with a value of 1.15 x 10{sup -2} {Omega} cm at 40 mK, which is characteristic of the metal-insulator transition region. Temperature-dependent conductivity {sigma}(T) in the low temperature range revealed that the electron-electron scattering is the dominant dephasing mechanism. The inelastic scattering time is found to vary as T{sup -3/2}.

Magnetic properties of NiMn{sub 2}O{sub 4−δ} (nickel manganite): Multiple magnetic phase transitions and exchange bias effect

Energy Technology Data Exchange (ETDEWEB)

Tadic, Marin, E-mail: marint@vinca.rs [Condensed Matter Physics Laboratory, Vinca Institute of Nuclear Sciences, University of Belgrade, POB 522, 11001 Belgrade (Serbia); Savic, S.M. [Institute for Multidisciplinary Research, University of Belgrade, Kneza Viseslava 1, 11000 Belgrade (Serbia); Jaglicic, Z. [University of Ljubljana, Faculty of Civil Engineering and Geodesy and Institute of Mathematics, Physics and Mechanics, Jadranska 19, 1000 Ljubljana (Slovenia); Vojisavljevic, K.; Radojkovic, A.; Prsic, S. [Institute for Multidisciplinary Research, University of Belgrade, Kneza Viseslava 1, 11000 Belgrade (Serbia); Nikolic, Dobrica [Department of Physics, University of Belgrade Faculty of Mining and Geology, Belgrade (Serbia)

2014-03-05

Highlights: • We have successfully synthesized NiMn{sub 2}O{sub 4−δ} sample by complex polymerization synthesis. • Magnetic measurements reveal complex properties and triple magnetic phase transitions. • Magnetic measurements of M(H) show hysteretic behavior below 120 K. • Hysteresis properties after cooling of the sample in magnetic field show exchange bias effect. -- Abstract: We present magnetic properties of NiMn{sub 2}O{sub 4−δ} (nickel manganite) which was synthesized by complex polymerization synthesis method followed by successive heat treatment and final calcinations in air at 1200 °C. The sample was characterized by using X-ray powder diffractometer (XRPD), scanning electron microscopy (SEM), field-emission scanning electron microscopy (FE-SEM) and superconducting quantum interference device (SQUID) magnetometer. The XRPD and FE-SEM studies revealed NiMn{sub 2}O{sub 4−δ} phase and good crystallinity of particles. No other impurities have been observed by XRPD. The magnetic properties of the sample have been studied by measuring the temperature and field dependence of magnetization. Magnetic measurements of M(T) reveal rather complex magnetic properties and multiple magnetic phase transitions. We show three magnetic phase transitions with transition temperatures at T{sub M1} = 35 K (long-range antiferromagnetic transition), T{sub M2} = 101 K (antiferromagnetic-type transition) and T{sub M3} = 120 K (ferromagnetic-like transition). We found that the T{sub M1} transition is strongly dependent on the strength of the applied magnetic field (T{sub M1} decreases with increasing applied field) whereas the T{sub M3} is field independent. Otherwise, the T{sub M2} maximum almost disappears in higher applied magnetic fields (H = 1 kOe and 10 kOe). Magnetic measurements of M(H) show hysteretic behavior below T{sub M3}. Moreover, hysteresis properties measured after cooling of the sample in magnetic field of 10 kOe show exchange bias effect with an

Magneto-resistive coefficient enhancement observed around Verwey-like transition on spinel ferrites XFe{sub 2}O{sub 4} (X = Mn, Zn)

Energy Technology Data Exchange (ETDEWEB)

López Maldonado, K. L., E-mail: liliana.lopez.maldonado@gmail.com; Vazquez Zubiate, L.; Elizalde Galindo, J. T. [Instituto de Ingeniería y Tecnología, Universidad Autónoma de Ciudad Juárez, Av. Del Charro 450 norte, 32310 Ciudad Juárez (Mexico); Presa, P. de la [Instituto de Magnetismo Aplicado (UCM-ADIF-CSIC), P.O. Box 155, 28230 Las Rozas (Spain); Departamento de Física de Materiales, Univ. Complutense de Madrid, Madrid (Spain); Matutes Aquino, J. A. [Centro de Investigación en Materiales Avanzados, Miguel de Cervantes 120, 31109 Chihuahua (Mexico)

2014-05-07

Manganese and Zinc ferrites were prepared by solid state reaction. The resulting powders were pressed into pellets and heat treated at 1100 °C. The samples were characterized by using X-ray diffraction, pure phases of zinc ferrite (ZnFe{sub 2}O{sub 4}) and manganese ferrite (MnFe{sub 2}O{sub 4}) were obtained. Scanning electron microscopy images showed a good contact between particles. A drop of electrical resistance was found in both samples, MnFe{sub 2}O{sub 4} and ZnFe{sub 2}O{sub 4}, with values going from 2750 to 130 Ω and from 1100 to 55 Ω, respectively. Transition temperatures were determined to be T{sub V} = 225 K for MnFe{sub 2}O{sub 4} and T{sub V} = 130 K for ZnFe{sub 2}O{sub 4}. Magnetoresistance measurements were carried out in the temperature range where R showed the transition, defined as the Verwey-like transition temperature range, ΔT{sub V}. No magnetoresistive effect was observed out of it. The magnetoresistive coefficient (MRC) observed at ΔT{sub V} reached its maximum values of 1.1% for MnFe{sub 2}O{sub 4} and 6.68% for ZnFe{sub 2}O{sub 4}. The differences between MRC values are related to the divalent metal element used. Finally, the magnetoresistive response indicates that the electrical transition observed is strongly influencing the magnetoresistance; where the underlying responsible for this behavior could be a charge reordering occurring at the Verwey-like transition temperature.

A comparative study of magnetic field induced meta-magnetic transition in nanocrystalline and bulk Pr{sub 0.65}(Ca{sub 0.7}Sr{sub 0.3}){sub 0.35}MnO{sub 3} compound

Energy Technology Data Exchange (ETDEWEB)

Saha, Suvayan [CMP Division, Saha Institute of Nuclear Physics, 1/AF, Bidhannagar, Kolkata 700 064 (India); Center for Research in Nanoscience and Nanotechnology, University of Calcutta, JD-2, Salt Lake City, Kolkata 700098, West Bengal (India); Department of Physics, University of Calcutta, 92 A.P.C. Road, Kolkata 700009 (India); Das, Kalipada, E-mail: kalipadadasphysics@gmail.com [Department of Materials Science, Indian Association for the Cultivation of Science, 2A and 2B Raja S.C. Mullick Road, Jadavpur, Kolkata 700032 (India); Bandyopadhyay, Sudipta [Center for Research in Nanoscience and Nanotechnology, University of Calcutta, JD-2, Salt Lake City, Kolkata 700098, West Bengal (India); Department of Physics, University of Calcutta, 92 A.P.C. Road, Kolkata 700009 (India); Das, I. [CMP Division, Saha Institute of Nuclear Physics, 1/AF, Bidhannagar, Kolkata 700 064 (India)

2017-06-15

Highlights: • Field induced sharp meta-magnetic transition appears even in nanocrystalline sample. • Magnetic field for the meta-magnetic transition enhances depending upon the cooling field. • This unusual behavior is addressed by the effect of the interfacial strains. - Abstract: In our present study we highlight the observations of external magnetic field induced sharp meta-magnetic transition in polycrystalline bulk as well as nanocrystalline form of Pr{sub 0.65}(Ca{sub 0.7}Sr{sub 0.7}){sub 0.35}MnO{sub 3} compound. Interestingly, such behavior persists in the nanoparticles regardless of the disorder broadened transition. However, higher magnetic field is required for nanoparticles having average particle size ∼40 nm for such meta-magnetic transition, which differs from the general trends of the pure charge ordered nano materials. The interfacial strain between the different magnetic domains plays the important role in magnetic isothermal properties of nanoparticles, when the samples are cooled down in different cooling field. Additionally, both the bulk and nanoparticle compounds exhibit spontaneous phase separation and significantly large magnetoresistance at the low temperature region due to the melting of charge ordered fraction.

Copper(II)-catalyzed exo and enantioselective cycloadditions of azomethine imines.

Science.gov (United States)

Sibi, Mukund P; Rane, Digamber; Stanley, Levi M; Soeta, Takahiro

2008-07-17

A strategy for exo and enantioselective 1,3-dipolar cycloaddition of azomethine imines to 2-acryloyl-3-pyrazolidinone is described. The corresponding cycloadducts are isolated with high diastereoselectivities (up to >96:4 exo/endo) and enantioselectivities (up to 98% ee).

Structural transition in Mo{sub 3}Sb{sub 7} probed by muon spin relaxation

Energy Technology Data Exchange (ETDEWEB)

Tabata, Y. [Department of Materials Science and Engineering, Kyoto University, Kyoto 606-8501 (Japan); Koyama, T.; Kohara, T. [Graduate School of Material Science, University of Hyogo, Kamigori, Ako-gun, Hyogo 678-1297 (Japan); Watanabe, I. [Advanced Meson Science Laboratory, RIKEN Nishina Center, Wako, Saitama 351-0198 (Japan); Nakamura, H., E-mail: h.nakamura@ht8.ecs.kyoto-u.ac.j [Department of Materials Science and Engineering, Kyoto University, Kyoto 606-8501 (Japan)

2009-04-15

Longitudinal-field muSR measurements have been made for Mo{sub 3}Sb{sub 7} focusing on the nature of the structural transition recently found at T{sub S}approx =50K. Taking account of a critical behavior of the relaxation rate lambda at approxT{sub S}, together with the motional narrowing of the nuclear dipolar field revealed in a zero-field experiment, and the tetragonal lattice symmetry lowering below T{sub S}, we propose long-range order of spin-singlet dimers, i.e., the formation of the valence bond crystal below T{sub S}. As a possible origin, the frustration in the interdimer antiferromagnetic interaction is suggested.

High-pressure behavior of A <sub>2sub> B <sub>2sub> O <sub>7sub> pyrochlore (A=Eu, Dy; B=Ti, Zr)

Energy Technology Data Exchange (ETDEWEB)

Rittman, Dylan R.; Turner, Katlyn M.; Park, Sulgiye; Fuentes, Antonio F.; Yan, Jinyuan; Ewing, Rodney C.; Mao, Wendy L.

2017-01-28

In situ high-pressure X-ray diffraction and Raman spectroscopy were used to determine the influence of composition on the high-pressure behavior of A<sub>2sub>B>2sub>O>7sub> pyrochlore (A=Eu, Dy; B=Ti, Zr) up to ~50GPa. Based on X-ray diffraction results, all compositions transformed to the high-pressure cotunnite structure. The B-site cation species had a larger effect on the transition pressure than the A-site cation species, with the onset of the phase transformation occurring at ~41 GPa for B=Ti and ~16 GPa B=Zr. However, the A-site cation affected the kinetics of the phase transformation, with the transformation for compositions with the smaller ionic radii, i.e., A=Dy, proceeding faster than those with a larger ionic radii, i.e., A=Eu. These results were consistent with previous work in which the radius-ratio of the A- and B-site cations determined the energetics of disordering, and compositions with more similarly sized A- and B-site cations had a lower defect formation energy. Raman spectra revealed differences in the degree of short-range order of the different compositions. Due to the large phase fraction of cotunnite at high pressure for B=Zr compositions, Raman modes for cotunnite could be observed, with more modes recorded for A=Eu than A=Dy. These additional modes are attributed to increased short-to-medium range ordering in the initially pyrochlore structured Eu<sub>2sub>Zr>2sub>O>7sub> as compared with the initially defect-fluorite structured Dy<sub>2sub>Zr>2sub>O>7sub>.

Electronic properties of new superconductors based on Ca(Al sub x Si sub 1 sub - sub x) sub 2 and Sr(Ga sub x Si sub 1 sub - sub x) sub 2 in crystal and nanotubular states

CERN Document Server

Shein, I R; Medvedeva, N I; Ivanovskij, A L

2002-01-01

The zone structures of the new Ca(Al sub x Si sub 1 sub - sub x) sub 2 and Sr(Ga sub x Si sub 1 sub - sub x) sub 2 layered superconductors (AlB sub 2 -type) are studied through the LMTO first-principle full-potential method. It is shown that the superconducting properties of the ternary silicides is conditioned by high density of the (Ca, Sr)d-states near the Fermi level, whereas the T sub C growth by the Sr(Ga sub x Si sub 1 sub - sub x) sub 2 -> Ca(Al sub x Si sub 1 sub - sub x) sub 2 transition is related to the increase in the photon frequencies due to the atoms mass decrease. Modeling the electron properties of the hypothetical (11, 11) and (20, 0) CaAlSi and SrGaSi nanotubes is accomplished. The silicide systems by transition from the crystalline to nanotubular state retain the metal-like properties. The template and film convolution methods may become the methods for obtaining the silicide nanotubes

Structural phase transitions in CsPbCl/sub 3/ and RbCdCl/sub 3/

Energy Technology Data Exchange (ETDEWEB)

Plesko, S; Kind, R; Roos, J [Swiss Federal Inst. of Technology, Zuerich. Lab. of Solid State Physics

1978-08-01

Structural phase transitions in CsPbCl/sub 3/ have been investigated by /sup 133/Cs and /sup 87/Rb nuclear magnetic resonance. The space groups of the room temperature phase in CsPbCl/sub 3/ and of two unknown phases in RbCdCl/sub 3/ could be clarified. Thus both perovskites show the same phase sequence from cubic Pm3m-O sub(h)sup(1) to tetragonal P4/mbm-D sub(4h)sup(5), orthorhombic Cmcm-D sub(2h)sup(17) and further orthorhombic Pnma-D sub(2h)sup(16).

Observation of chemical separation of In{sub 3}Sb{sub 1}Te{sub 2} thin film during phase transition

Energy Technology Data Exchange (ETDEWEB)

Lee, Y.M.; Baik, J.; Shin, H.-J. [Beamline Division, Pohang Accelerator Laboratory, POSTECH, Pohang 790-784 (Korea, Republic of); Kim, Y.S. [Department of Physics and Energy Harvest-Storage Research Center (EHSRC), University of Ulsan, Ulsan 680-749 (Korea, Republic of); Yoon, S.G., E-mail: sgyoon@cnu.ac.kr [Brain Korea 21 Project (BK21) and Department of Materials Engineering, Chungnam University, Daejeon 305-764 (Korea, Republic of); Jung, M.-C., E-mail: mcjung@oist.jp [Energy Materials and Surface Sciences Unit, Okinawa Institute of Science and Technology Graduate University, Okinawa 904-0495 (Japan); Qi, Y.B. [Energy Materials and Surface Sciences Unit, Okinawa Institute of Science and Technology Graduate University, Okinawa 904-0495 (Japan)

2014-02-15

We investigated the chemical states of In{sub 3}Sb{sub 1}Te{sub 2} (IST) thin film using high-resolution X-ray photoelectron spectroscopy (HRXPS) with the synchrotron radiation during in-situ annealing in ultra-high vacuum. To obtain the oxygen-free amorphous IST (a-IST), we performed the mild Ne{sup +} ion sputtering. And also we confirmed the relative a-IST stoichiometry to be 54%:17%:29% based on HRXPS data. At the first and second phase transition temperatures of 350 and 400 °C, we observed the dramatic changes of chemical states from a-IST to InSb and the mixture of crystalline-IST and InTe, respectively. There was a depletion of Sb atoms on the surface after annealing at 750 °C. We assume that Sb atom is a key for the phase transition in IST. However, chemical state of the Sb in IST is unstable during the phase transition and it will be caused with the non-reversible process by this structural instability.

Acoustic emission during the ferroelectric transition Pm3{sup ¯}m to P4mm in BaTiO{sub 3} and the ferroelastic transition R3{sup ¯}m-C2/c in Pb{sub 3}(PO{sub 4}){sub 2}

Energy Technology Data Exchange (ETDEWEB)

Salje, E. K. H. [Department of Earth Sciences, University of Cambridge, Cambridge CB2 3EQ (United Kingdom); Dul' kin, E.; Roth, M. [Department of Applied Physics, The Hebrew University of Jerusalem, Jerusalem 91904 (Israel)

2015-04-13

Acoustic emission (AE) spectroscopy without frequency filtering (∼broadband AE) and moderate time integration is shown to be sensitive enough to allow the investigation of subtle nano-structural changes in ferroelectric BaTiO{sub 3} and ferroelastic Pb{sub 3}(PO{sub 4}){sub 2}. AE signals during weak phase transitions are compatible with avalanche statistics as observed previously in large-strain systems. While the data are too sparse to determine avalanche exponents, they are well suited to determine other thermodynamic parameters such as transition temperatures and critical stresses.

Prediction of electronically nonadiabatic decomposition mechanisms of isolated gas phase nitrogen-rich energetic salt: Guanidium-triazolate

Energy Technology Data Exchange (ETDEWEB)

Ghosh, Jayanta; Bhattacharya, Atanu, E-mail: atanub@ipc.iisc.ernet.in

2016-01-13

Highlights: • Decomposition mechanisms of model energetic salt, guanidium triazolate, are explored. • Decomposition pathways are electronically nonadiabatic. • CASPT2, CASMP2 and CASSCF methodologies are employed. • N{sub 2} and NH{sub 3} are predicted to be the most possible initial decomposition products. - Abstract: Electronically nonadiabatic decomposition pathways of guanidium triazolate are explored theoretically. Nonadiabatically coupled potential energy surfaces are explored at the complete active space self-consistent field (CASSCF) level of theory. For better estimation of energies complete active space second order perturbation theories (CASPT2 and CASMP2) are also employed. Density functional theory (DFT) with B3LYP functional and MP2 level of theory are used to explore subsequent ground state decomposition pathways. In comparison with all possible stable decomposition products (such as, N{sub 2}, NH{sub 3}, HNC, HCN, NH{sub 2}CN and CH{sub 3}NC), only NH{sub 3} (with NH{sub 2}CN) and N{sub 2} are predicted to be energetically most accessible initial decomposition products. Furthermore, different conical intersections between the S{sub 1} and S{sub 0} surfaces, which are computed at the CASSCF(14,10)/6-31G(d) level of theory, are found to play an essential role in the excited state deactivation process of guanidium triazolate. This is the first report on the electronically nonadiabatic decomposition mechanisms of isolated guanidium triazolate salt.

Phase transition and conduction mechanism in Pb{sub 2}Na{sub 0.8}R{sub 0.2}Nb{sub 4.8}Fe{sub 0.2}O{sub 15} material (R=rare earth)

Energy Technology Data Exchange (ETDEWEB)

Bouziane, M. [Laboratoire de Chimie du Solide Appliquée, Faculté des Sciences, Université Mohammed V-Agdal, Avenue Ibn Batouta, BP 1014 Rabat (Morocco); Taibi, M., E-mail: taibiens@yahoo.fr [Laboratoire de Physico-Chimie des Matériaux (LAF 502), Ecole Normale Supérieure, Université Mohammed V-Agdal, BP 5118 Rabat (Morocco); Boukhari, A. [Laboratoire de Chimie du Solide Appliquée, Faculté des Sciences, Université Mohammed V-Agdal, Avenue Ibn Batouta, BP 1014 Rabat (Morocco)

2013-11-15

Electrical properties of Pb{sub 2}Na{sub 0.8}Eu{sub 0.2}Nb{sub 4.8}Fe{sub 0.2}O{sub 15} tungsten bronze compound were investigated. Ferroelectric phase transition of diffuse type is observed at 395 °C. Conductivity study as a function of temperature (RT-600 °C) and at three different frequencies (10, 100 and 1000 kHz) suggests the existence of dominant ionic conduction. The rise of ac conductivity on increasing temperature supports the NTCR (negative temperature coefficient of resistance) behaviour of the material. The activation energies have been evaluated from ac conductivity using Arrhenius equation and discussed. Different conduction mechanisms were identified. For comparison, the conducting properties of Pb{sub 2}Na{sub 0.8}R{sub 0.2}Nb{sub 4.8}Fe{sub 0.2}O{sub 15} (R=Dy, Nd, La) were also investigated. - Graphical abstract: Thermal evolution of lnσ{sub ac} of Pb{sub 2}Na{sub 0.8}Eu{sub 0.2}Nb{sub 4.8}Fe{sub 0.2}O{sub 15} at selected frequencies. Display Omitted - Highlights: • We found that TB compounds exhibit a diffuse type of first- order transition. • A negative temperature coefficient of resistance (NTCR) behaviour is observed. • Three conduction mechanisms were identified: n-and/or p-type at low temperatures. • The conduction mechanism in the studied compounds is very complex.

Density-functional theory study of the pressure-induced phase transition in hydronitrogen compound N{sub 4}H{sub 4}

Energy Technology Data Exchange (ETDEWEB)

Liu, Qi-Jun, E-mail: qijunliu@home.swjtu.edu.cn [Bond and Band Engineering Group, Sichuan Provincial Key Laboratory (for Universities) of High Pressure Science and Technology, School of Physical Science and Technology, Southwest Jiaotong University, Chengdu, Sichuan 610031 (China); Zhang, Ning-Chao; Sun, Yan-Yun; Zhang, Ming-Jian; Liu, Fu-Sheng [Bond and Band Engineering Group, Sichuan Provincial Key Laboratory (for Universities) of High Pressure Science and Technology, School of Physical Science and Technology, Southwest Jiaotong University, Chengdu, Sichuan 610031 (China); Liu, Zheng-Tang [State Key Laboratory of Solidification Processing, School of Materials Science and Engineering, Northwestern Polytechnical University, Xi' an, Shaanxi 710072 (China)

2014-03-01

Using first-principles density-functional theory, we have investigated the pressure-induced phase transition in hydronitrogen compound N{sub 4}H{sub 4} and discussed the potential tetragonal structure. We find that tetragonal structure with P4{sub 2}/n space group is mechanically stable and ductile. The thermodynamic stability of Pmna>P1{sup ¯}>P4{sub 2}/n>P2{sub 1}/m has been obtained. With increasing pressure, the phase transition pressures of T{sub Pmna→P4{sub 2/n}}, T{sub P4{sub 2/n→Pmna}}, T{sub Pmna→P1{sup ¯}} and T{sub P1{sup ¯}→P2{sub 1/m}} are 5.6, 15.0, 30.0 and 69.2 GPa, respectively, which are in agreement with the available data. Moreover, the mechanical stability of four structures under pressure has been analyzed.

HAT-P-49b: a 1.7 M {sub J} planet transiting a bright 1.5 M {sub ☉} F-star

Energy Technology Data Exchange (ETDEWEB)

Bieryla, A.; Latham, D. W.; Buchhave, L. A.; Béky, B.; Falco, E.; Torres, G.; Noyes, R. W.; Berlind, P.; Calkins, M. C.; Esquerdo, G. A. [Harvard-Smithsonian Center for Astrophysics, Cambridge, MA 02138 (United States); Hartman, J. D.; Bakos, G. Á.; Bhatti, W.; Csubry, Z.; Penev, K.; De Val-Borro, M. [Department of Astrophysical Sciences, Princeton University, Princeton, NJ 08544 (United States); Kovács, G. [Konkoly Observatory, Budapest 1121 (Hungary); Boisse, I. [Centro de Astrofísica, Universidade do Porto, Rua das Estrelas, 4150-762 Porto (Portugal); Lázár, J.; Papp, I., E-mail: abieryla@cfa.harvard.edu, E-mail: gbakos@astro.princeton.edu [Hungarian Astronomical Association (HAA), Budapest 1461 (Hungary); and others

2014-04-01

We report the discovery of the transiting extrasolar planet HAT-P-49b. The planet transits the bright (V = 10.3) slightly evolved F-star HD 340099 with a mass of 1.54 M {sub ☉} and a radius of 1.83 R {sub ☉}. HAT-P-49b is orbiting one of the 25 brightest stars to host a transiting planet which makes this a favorable candidate for detailed follow-up. This system is an especially strong target for Rossiter-McLaughlin follow-up due to the host star's fast rotation, 16 km s{sup –1}. The planetary companion has a period of 2.6915 days, mass of 1.73 M {sub J}, and radius of 1.41 R {sub J}. The planetary characteristics are consistent with that of a classical hot Jupiter but we note that this is the fourth most massive star to host a transiting planet with both M{sub p} and R{sub p} well determined.

Impact of atmospheric refraction: how deeply can we probe exo-earth's atmospheres during primary eclipse observations?

Energy Technology Data Exchange (ETDEWEB)

Bétrémieux, Yan [Max-Planck-Institut für Astronomie, Königstuhl 17, D-69117 Heidelberg (Germany); Kaltenegger, Lisa, E-mail: betremieux@mpia.de [Also at Harvard-Smithsonian Center for Astrophysics, 60 Garden Street, Cambridge, MA 02138, USA. (United States)

2014-08-10

Most models used to predict or fit exoplanet transmission spectra do not include all the effects of atmospheric refraction. Namely, the angular size of the star with respect to the planet can limit the lowest altitude, or highest density and pressure, probed during primary eclipses as no rays passing below this critical altitude can reach the observer. We discuss this geometrical effect of refraction for all exoplanets and tabulate the critical altitude, density, and pressure for an exoplanet identical to Earth with a 1 bar N{sub 2}/O{sub 2} atmosphere as a function of both the incident stellar flux (Venus, Earth, and Mars-like) at the top of the atmosphere and the spectral type (O5-M9) of the host star. We show that such a habitable exo-Earth can be probed to a surface pressure of 1 bar only around the coolest stars. We present 0.4-5.0 μm model transmission spectra of Earth's atmosphere viewed as a transiting exoplanet, and show how atmospheric refraction modifies the transmission spectrum depending on the spectral type of the host star. We demonstrate that refraction is another phenomenon that can potentially explain flat transmission spectra over some spectral regions.

Magnetic properties and structural transitions of fluorite-related rare earth osmates Ln{sub 3}OsO{sub 7} (Ln=Pr, Tb)

Energy Technology Data Exchange (ETDEWEB)

Hinatsu, Yukio, E-mail: hinatsu@sci.hokudai.ac.jp [Division of Chemistry, Graduate School of Science, Hokkaido University, Sapporo 060-0810 (Japan); Doi, Yoshihiro [Division of Chemistry, Graduate School of Science, Hokkaido University, Sapporo 060-0810 (Japan)

2013-02-15

Ternary rare-earth osmates Ln{sub 3}OsO{sub 7} (Ln=Pr, Tb) have been prepared. They crystallize in an ortho-rhombic superstructure of cubic fluorite with space group Cmcm. Both of these compounds undergo a structural phase transition at 130 K (Ln=Pr) and 580 K (Ln=Tb). These compounds show complex magnetic behavior at low temperatures. Pr{sub 3}OsO{sub 7} exhibits magnetic transitions at 8 and 73 K, and Tb{sub 3}OsO{sub 7} magnetically orders at 8 and 60 K. The Os moments become one-dimensionally ordered, and when the temperature is furthermore decreased, it provokes the ordering in the Ln{sup 3+} sublattice that simultaneously becomes three-dimensionally ordered with the Os sublattice. - Graphical abstract: Ternary rare-earth osmates Ln{sub 3}OsO{sub 7} (Ln=Pr, Tb) have been prepared. They crystallize in an orthorhombic superstructure of cubic fluorite with space group Cmcm. Both of these compounds undergo a structural phase transition at 130 K (Ln=Pr) and 580 K (Ln=Tb). These compounds show complex magnetic behavior at low temperatures. Pr{sub 3}OsO{sub 7} exhibits magnetic transitions at 8 and 73 K, and Tb{sub 3}OsO{sub 7} magnetically orders at 8 and 60 K. Highlights: Black-Right-Pointing-Pointer Ternary rare-earth osmates Ln{sub 3}OsO{sub 7} (Ln=Pr, Tb) with an ordered defect-fluorite structure have been prepared. Black-Right-Pointing-Pointer Both of these compounds undergo a structural phase transition at 130 K (Ln=Pr) and 580 K (Ln=Tb). Black-Right-Pointing-Pointer These compounds show complex magnetic behavior at low temperatures due to magnetic ordering of Ln and Os.

Metal-insulator transition in SrTi{sub 1−x}V{sub x}O{sub 3} thin films

Energy Technology Data Exchange (ETDEWEB)

Gu, Man [Department of Physics, University of Virginia, 382 McCormick Rd., Charlottesville, Virginia 22904 (United States); Wolf, Stuart A. [Department of Physics, University of Virginia, 382 McCormick Rd., Charlottesville, Virginia 22904 (United States); Department of Materials Science and Engineering, University of Virginia, 395 McCormick Rd., Charlottesville, Virginia 22904 (United States); Lu, Jiwei [Department of Materials Science and Engineering, University of Virginia, 395 McCormick Rd., Charlottesville, Virginia 22904 (United States)

2013-11-25

Epitaxial SrTi{sub 1−x}V{sub x}O{sub 3} (0 ≤ x ≤ 1) thin films were grown on (001)-oriented (LaAlO{sub 3}){sub 0.3}(Sr{sub 2}AlTaO{sub 6}){sub 0.7} (LSAT) substrates using the pulsed electron-beam deposition technique. The transport study revealed a temperature driven metal-insulator transition (MIT) at 95 K for x = 0.67. The films with higher vanadium concentration (x > 0.67) were metallic corresponding to a Fermi liquid system. In the insulating phase (x < 0.67), the resistivity behavior was governed by Mott's variable range hopping mechanism. The possible mechanisms for the induced MIT are discussed, including the effects of electron correlation, lattice distortion, and Anderson localization.

The Dopants and Doping Level Dependence of the Structure and Magnetic Properties of the Eu (BA<sub>1-xsub>LR_x)>2sub>Cu>3sub>O>7+δsub>

Energy Technology Data Exchange (ETDEWEB)

Lin, Yu [Iowa State Univ., Ames, IA (United States)

2002-12-31

Eu(Ba<sub>1-xsub>LR_x)>2sub>Cu>3sub>O>7+δsub> were systematically studied in order to understand how the valence of the rear earth elements, ionic sizes and magnetic moment affect the crystal structure and magnetic and electrical properties. Differential thermal analyses were carried out to check the phase purity, X-ray data were least-squares fitted to determine the lattice parameters, and DC-SQUID magnetometry was used to characterize the superconducting properties. These results showed that the crystallography is consistent with other EuLR123ss series, LR = La, Pr, Eu. The lattice parameters vary with the ionic radii of the rare earth ions. Unlike the uniform change in lattice parameter, the superconducting transition did not vary systematically with the ionic size of the dopants. Although the general trend was for T<sub>c> to decrease with decreasing ionic size of the dopant, for the same doping level, Pr was anomalous, depressing T<sub>c> faster. Although the exact mechanism is not clear, this result is consistent with the depression of T<sub>c> for Pr substitution for the rare earth in R123. The critical current J<sub>c> was determined using the Bean model from magnetization versus field measurements as a function of temperature and field. The effect of the dopants on J<sub>c> with the increasing of temperature or applied field was determined. For T < 77 K and small values of x, the value of J<sub>c> was increased over that of the x = 0 sample. In addition, the smaller the substituting atom, the higher the J<sub>c> becomes. For instance, at x = 0.025, Eu123 < EuLa.025 < EuPr.025 < EuNd.025 < EuEu.025. The enhancement of J<sub>c> disappears for x > 0.05 and T > 0.5T<sub>c>.

The condition and the dynamics of changes of regional energetic safety level

OpenAIRE

Anatoliy Myzin; Aleksey Kalina; Andrey Kozitsyn; Pavel Pykhov

2006-01-01

On the basis of indicative analysis method use, the dynamic processes of changes of energetic safety condition of federal districts and subjects of Russian Federation for last 5 years are investigated. The results of diagnosing safety levels for separate indicators, their blocks and the results of situation evaluation as a whole are discussed. The comparison of regions’ energetic safety condition is given, the causes of crisis situations appearance are discovered, and on this basis the sugg...

Purification and Characterization of Exo-Inulinase from Paenibacillus sp. d9 Strain.

Science.gov (United States)

Jeza, S; Maseko, S B; Lin, J

2018-02-01

This study intended to purify and characterise exo-inulinase of diesel-degrading Paenibacillus sp. D9. The whole genome sequencing of Paenibacillus sp. D9 revealed to possess the sacC gene that is encoded as exo-inulinase/levanase. This isolate was capable of producing a maximum of 50.9 IU/mL of exo-inulinase activity within 3 days at 30 °C, 200 rpm and pH of 7.0 on minimal salt medium agar supplemented with 1% (w/v) inulin. An exo-inulinase of 58.5 kDa was purified using ammonium sulphate precipitation, HiTrap QFF column and MMC column chromatographies with a specific activity of 4333 IU/mg, 7.1% recovery and a 4.3-fold increase in purity. The purified D9 exo-inulinase had temperature and pH optimum at 40 °C and pH 4.0, respectively, with the Michaelis constant of 5.5 mM and a maximal velocity of 476.2 IU/mg, respectively. Catalytic constant, k cat was calculated to be 42.6 s -1 with a catalytic efficiency (k cat /K m ) of 7.6 s -1  mM -1 . The presence of Ca 2+ enhanced the activity of D9 exo-inulinase while Hg 2+ completely inhibited the activity, other compounds such as Fe 3+ and Cu 2+ had an inhibitory effect. The results of amino acid alignment and the complete degradation of inulin into fructose by the purified enzyme confirmed that inulinase from Paenibacillus sp. D9 is an exo-form. The phylogenetic tree based on the protein sequences indicates that bacterial exo-inulinases possess a common ancestry.

Anomalous transition strength in the proton-unbound nucleus {sup 109}{sub 53}I{sub 56}

Energy Technology Data Exchange (ETDEWEB)

Procter, M.G., E-mail: mark.procter@postgrad.manchester.ac.uk [School of Physics and Astronomy, Schuster Laboratory, The University of Manchester, Manchester M13 9PL (United Kingdom); Cullen, D.M. [School of Physics and Astronomy, Schuster Laboratory, The University of Manchester, Manchester M13 9PL (United Kingdom); Department of Physics, University of Jyvaeskylae, FIN-40014 Jyvaeskylae (Finland); Scholey, C.; Ruotsalainen, P. [Department of Physics, University of Jyvaeskylae, FIN-40014 Jyvaeskylae (Finland); Angus, L. [University of The West of Scotland, High Street, Paisley PA1 2BE (United Kingdom); Baeck, T.; Cederwall, B. [Department of Physics, Royal Institute of Technology, SE-10691 Stockholm (Sweden); Dewald, A.; Fransen, C. [Institut fuer Kernphysik, Universitaet zu Koeln, D-50937, Koeln (Germany); Grahn, T. [Department of Physics, University of Jyvaeskylae, FIN-40014 Jyvaeskylae (Finland); Oliver Lodge Laboratory, University of Liverpool, Liverpool L69 7ZE (United Kingdom); Greenlees, P.T. [Department of Physics, University of Jyvaeskylae, FIN-40014 Jyvaeskylae (Finland); Hackstein, M. [Institut fuer Kernphysik, Universitaet zu Koeln, D-50937, Koeln (Germany); Jakobsson, U.; Jones, P.M.; Julin, R.; Juutinen, S.; Ketelhut, S.; Leino, M. [Department of Physics, University of Jyvaeskylae, FIN-40014 Jyvaeskylae (Finland); Liotta, R. [Department of Physics, Royal Institute of Technology, SE-10691 Stockholm (Sweden); Lumley, N.M. [School of Physics and Astronomy, Schuster Laboratory, The University of Manchester, Manchester M13 9PL (United Kingdom)

2011-10-13

A lifetime measurement has been made for the first excited 11/2{sup +} state in the proton-unbound nucleus {sup 109}{sub 53}I{sub 56} using the recoil-distance Doppler-shift method in conjunction with recoil-proton tagging. The experimental reduced transition probability is considerably smaller than the prediction of theoretical shell-model calculations using the CD-Bonn nucleon-nucleon potential. The discrepancy between the theoretical and experimental reduced transition strengths in this work most likely arises from the inability of the current shell-model calculations to accurately account for the behavior of the unbound nuclear states.

Spin-driven pyroelectricity in Ni{sub 3}TeO{sub 6} without ferroelectric signatures of the transition at Neel temperature

Energy Technology Data Exchange (ETDEWEB)

Zhao, L.; Komarek, A.C. [Max-Planck-Institute for Chemical Physics of Solids, Dresden (Germany); Du, C.H. [Department of Physics, Tamkang University, Tamsui, Taiwan (China)

2017-07-15

Here we report on dielectric studies on Ni{sub 3}TeO{sub 6}. We confirm the spin-driven pyroelectric transition at the Neel temperature (T{sub N}) of ∝52.5 K. The measurement of single crystalline and polycrystalline samples excludes a ferroelectric nature of the transition at T{sub N} in this compound. The excellent pyroelectric properties without any intrinsic ferroelectric hysteresis make Ni{sub 3}TeO{sub 6} appropriate for applications in future devices. Pyroelectric measurements on our Ni{sub 3}TeO{sub 6} single crystals. The polarization that appears on cooling through T{sub N} can not be inverted by opposite poling fields (applied when cooling from above T{sub N} to base temperature). (copyright 2017 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

Isolation and Characterization of Lactic Acid Bacteria (LAB) Produced Exo cellular Polysaccharide

International Nuclear Information System (INIS)

Meleigy, S.A.; Hendawy, W.S.

2009-01-01

Isolation and characterization of exo cellular polysaccharide was studied in order to evaluate some parameters in the synthesis of exo polysaccharide (EPS) and improve their production through submerged fermentation processes. Isolation strains Lactobacillus delbrueckii ssp bulgaricus (IS 1 ), Lactococcus lactis ssp cremoris (IS 2 ) and Lactobacillus delbrueckii ssp bulgaricus (IS 3 ) were studied in shake flasks using yeast extract, surfactants and different exposure doses of gamma irradiation.The optimum concentration of (EPS) formation (0.762 g/l) by Lactococcus lactis ssp cremoris (IS 2 ), 3.0 (g/l) yeast extract, 1.72 (g/l) at 0.5 (%) surfactant Triton X-100. Also, EPS (1.842 g/l) was produced when Lactococcus lactis ssp cremoris (IS 2 ) exposed to 0.2 kGy dose level.

Cobalt surface modification during γ-Fe{sub 2}O{sub 3} nanoparticle synthesis by chemical-induced transition

Energy Technology Data Exchange (ETDEWEB)

Li, Junming [School of Physical Science and Technology, Southwest University, Chongqing 400715 (China); Li, Jian, E-mail: aizhong@swu.edu.cn [School of Physical Science and Technology, Southwest University, Chongqing 400715 (China); Chen, Longlong; Lin, Yueqiang; Liu, Xiaodong; Gong, Xiaomin [School of Physical Science and Technology, Southwest University, Chongqing 400715 (China); Li, Decai [School of Mechanical and Control Engineering, Beijing Jiaotong University, Beijing 100044 (China)

2015-02-01

In the chemical-induced transition of FeCl{sub 2} solution, the FeOOH/Mg(OH){sub 2} precursor was transformed into spinel structured γ-Fe{sub 2}O{sub 3} crystallites, coated with a FeCl{sub 3}·6H{sub 2}O layer. CoCl{sub 2} surface modified γ-Fe{sub 2}O{sub 3} nanoparticles were prepared by adding Co(NO{sub 3}){sub 2} during the synthesis. CoFe{sub 2}O{sub 4} modified γ-Fe{sub 2}O{sub 3} nanoparticles were prepared by adding NaOH during the surface modification with Co(NO{sub 3}){sub 2}. The CoFe{sub 2}O{sub 4} layer grew epitaxially on the γ-Fe{sub 2}O{sub 3} crystallite to form a composite crystallite, which was coated by CoCl{sub 2}·6H{sub 2}O. The composite could not be distinguished using X-ray diffraction or transmission electron microscopy, since CoFe{sub 2}O{sub 4} and γ-Fe{sub 2}O{sub 3} possess similar spinel structures and lattice constants. X-ray photoelectron spectroscopy was used to distinguish them. The saturation magnetization and coercivity of the spinel structured γ-Fe{sub 2}O{sub 3}-based nanoparticles were related to the grain size. - Highlights: • γ-Fe{sub 2}O{sub 3} nanoparticles were synthesized by chemical induced transition. • CoCl{sub 2} modified nanoparticles were prepared by additional Co(NO{sub 3}){sub 2} during synthesization. • CoFe{sub 2}O{sub 4} modified nanoparticles were prepared by additional Co(NO{sub 3}){sub 2} and NaOH. • The magnetism of the nanoparticles is related to the grain size.

ExoMol line list - XXI. Nitric Oxide (NO)

Science.gov (United States)

Wong, Andy; Yurchenko, Sergei N.; Bernath, Peter; Müller, Holger S. P.; McConkey, Stephanie; Tennyson, Jonathan

2017-09-01

Line lists for the X 2Π electronic ground state for the parent isotopologue of nitric oxide (14N16O) and five other major isotopologues (14N17O, 14N18O, 15N16O, 15N17O and 15N18O) are presented. The line lists are constructed using empirical energy levels (and line positions) and high-level ab initio intensities. The energy levels were obtained using a combination of two approaches, from an effective Hamiltonian and from solving the rovibronic Schrödinger equation variationally. The effective Hamiltonian model was obtained through a fit to the experimental line positions of NO available in the literature for all six isotopologues using the programs spfit and spcat. The variational model was built through a least squares fit of the ab initio potential and spin-orbit curves to the experimentally derived energies and experimental line positions of the main isotopologue only using the duo program. The ab initio potential energy, spin-orbit and dipole moment curves (PEC, SOC and DMC) are computed using high-level ab initio methods and the marvel method is used to obtain energies of NO from experimental transition frequencies. The line lists are constructed for each isotopologue based on the use of the most accurate energy levels and the ab initio DMC. Each line list covers a wavenumber range from 0 to 40 000 cm-1 with approximately 22 000 rovibronic states and 2.3-2.6 million transitions extending to Jmax = 184.5 and vmax = 51. Partition functions are also calculated up to a temperature of 5000 K. The calculated absorption line intensities at 296 K using these line lists show excellent agreement with those included in the HITRAN and HITEMP data bases. The computed NO line lists are the most comprehensive to date, covering a wider wavenumber and temperature range compared to both the HITRAN and HITEMP data bases. These line lists are also more accurate than those used in HITEMP. The full line lists are available from the CDS http://cdsarc.u-strasbg.fr and ExoMol www

Electronic band structure and charge density wave transition in quasi-2D KMo{sub 6}O{sub 17} purple bronze

Energy Technology Data Exchange (ETDEWEB)

Valbuena, M A [Instituto de Ciencia de Materiales de Madrid, CSIC, 28049 Madrid (Spain); Avila, J; Asensio, M C [Synchrotron SOLEIL, L' Orme des Merisiers, Saint-Aubin, B.P. 48, 91192 Gif-sur-Yvette Cedex (France); Vyalikh, D V; Laubschat, C; Molodtsov, S L [Institut fuer Festkoerperphysik, Technische Universitaet Dresden, D-01062 Dresden (Germany); Guyot, H [LEPES, CNRS, BP 166, 38042 Grenoble Cedex 9 (France)], E-mail: mvbuena@icmm.csic.es

2008-03-15

High resolution angle-resolved photoemission of quasi-2D KMo{sub 6}O{sub 17} purple bronze has been performed in the range from room temperature to 130 K, slightly above the charge density wave (CDW) transition (T{sub c} = 110 K), and down to 35 K (well below T{sub c}). In this paper we report a detailed study of how electronic band structure is affected by this transition driven by the hidden nesting scenario. The expected spectroscopic fingerprints of the CDW phase transition have been found and discussed according to the hidden one dimension and the development of a quasi-commensurate CDW. The excellent agreement between theory and our experimental results makes of potassium purple bronze a reference system for studying this type of instabilities.

Transition-metal-free synthesis of imidazo[2,1-b]thiazoles and thiazolo[3,2-a]benzimidazoles via an S-propargylation/5-exo-dig cyclization/isomerization sequence using propargyl tosylates as substrates.

Science.gov (United States)

Omar, Mohamed A; Frey, Wolfgang; Conrad, Jürgen; Beifuss, Uwe

2014-11-07

A transition-metal-free route for the synthesis of several N-fused heterocycles, including thiazolo[3,2-a]benzimidazoles and imidazo[2,1-b]thiazoles, is reported. The reaction between propargyl tosylates and 2-mercaptobenzimidazoles under basic conditions results in 3-substituted thiazolo[3,2-a]benzimidazoles, in yields up to 92% in a single synthesis step. With 2-mercaptoimidazoles as the substrate, the corresponding imidazo[2,1-b]thiazoles were exclusively obtained. The transformation is considered to proceed as an intermolecular S-propargylation that is followed by 5-exo-dig ring closure and double-bond isomerization.

La{sub 0.7}Sr{sub 0.3}MnO{sub 3} thin films deposited by pulsed laser ablation for spintronic applications

Energy Technology Data Exchange (ETDEWEB)

Martino, Maurizio; Cesaria, Maura; Caricato, Anna Paola [Physics Department, University of Salento, Via Arnesano, 73100 Lecce (Italy); Maruccio, Giuseppe [Physics Department, University of Salento, Via Arnesano, 73100 Lecce (Italy); NNL CNR-Istituto di Nanoscienze, Via Arnesano, 73100 Lecce (Italy); Cola, Adriano; Farella, Isabella [Institute for Microelectronics and Microsystems, IMM-CNR, 73100 Lecce (Italy)

2011-08-15

Among spintronic materials, mixed-valence manganite La{sub 0.7}Sr{sub 0.3}MnO{sub 3} (LSMO) is widely investigated due to its half-metal nature. LSMO thin films were grown by pulsed laser deposition (PLD) onto amorphous silica substrates heated at nearly 600 C. An ArF excimer laser was chosen to induce ablation due to its more energetic photons compared to the other quoted excimer laser sources. Different oxygen pressures were considered in order to study the influence of oxygen on the LSMO optical and electrical properties. In this respect, the visible transparency percentage of the deposited films is found good enough for spin-OLED applications. The absorption coefficient shows an absorption band tunable as a function of the oxygen content. Its energetic location and evolution with the oxygen content demonstrate it originates from radiative transitions between the spin-majority bands separated by the Jahn-Teller distortion. All of this lets relate the deposition oxygen pressure to the Mn{sup 3+} ion content in each film and interpret electrical data. The 200 and 100 nm thick samples exhibit weak metallic transport behavior at room temperature with a resistivity of 4.8 and 6.9 {omega} cm, respectively. Concerning the resistivity response versus temperature, the measured low metal-insulator transition temperature (150 K) is related to the sample structural features as involved by the depositions. Two different transport mechanisms describe the conductivity regime of the deposited samples, namely the small polaron variable range hopping (VRH) and the Arrhenius law. (Copyright copyright 2011 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

Engineering of the energetic structure of the anode of organic photovoltaic devices utilizing hot-wire deposited transition metal oxide layers

Energy Technology Data Exchange (ETDEWEB)

Vasilopoulou, M., E-mail: mariva@imel.demokritos.gr [Institute of Nanoscience and Nanotechnology, Department of Microelectronics, National Center for Scientific Research Demokritos, POB 60228, 15310 Agia Paraskevi, Attiki (Greece); Stathopoulos, N.A.; Savaidis, S.A. [Department of Electronics, Technological and Educational Institute (TEI) of Piraeus, Petrou Ralli & Thivon, 12244 Aegaleo (Greece); Kostis, I. [Institute of Nanoscience and Nanotechnology, Department of Microelectronics, National Center for Scientific Research Demokritos, POB 60228, 15310 Agia Paraskevi, Attiki (Greece); Department of Electronics, Technological and Educational Institute (TEI) of Piraeus, Petrou Ralli & Thivon, 12244 Aegaleo (Greece); Papadimitropoulos, G. [Institute of Nanoscience and Nanotechnology, Department of Microelectronics, National Center for Scientific Research Demokritos, POB 60228, 15310 Agia Paraskevi, Attiki (Greece); Davazoglou, D., E-mail: d.davazoglou@imel.demokritos.gr [Institute of Nanoscience and Nanotechnology, Department of Microelectronics, National Center for Scientific Research Demokritos, POB 60228, 15310 Agia Paraskevi, Attiki (Greece)

2015-09-30

Graphical abstract: In this work we perform successful engineering of the anode of organic photovoltaics based on poly(3-hexylthiophene):[6,6]-phenyl butyric acid methyl ester blends by using metal oxide transport layers exhibiting shallow gap states which act as a barrier-free path for hole transport toward the anode. - Highlights: • Interface engineering of the anode. • Organic photovoltaics (OPVs). • Shallow gap states. • Barrier-free hole transport. • Design rules for interface engineering in OPVs. - Abstract: In this work we use hydrogen deposited molybdenum and tungsten oxides (chemically described as H:MO{sub x}x ≤ 3 where M = Mo or W) to control the energetics at the anode of bulk heterojunction (BHJ) organic photovoltaics (OPVs) based on poly(3-hexylthiophene):[6,6]-phenyl butyric acid methyl ester (P3HT:PC{sub 71}BM) blends. Significantly improved current densities and open circuit voltages were achieved as a result of improved hole transport from the P3HT highest occupied molecular orbital (HOMO) toward indium tin oxide (ITO) anode. This was attributed to the formation of shallow gap states in these oxides which are located just below the Fermi level and above the polymer HOMO and thus may act as a barrier-free path for the extraction of holes. Consequently, these states can be used for controlling the energetic structure of the anode of OPVs. By using ultraviolet photoelectron spectroscopy it was found that dependent on the deposition conditions these gap states and work function of the metal oxides may be tailored to contribute to the precise alignment of the HOMO of the organic semiconductor (OSC) with the Fermi level of the anode electrode resulting in further enhancement of the device performance.

Exo-erythrocytic development of avian malaria and related haemosporidian parasites.

Science.gov (United States)

Valkiūnas, Gediminas; Iezhova, Tatjana A

2017-03-03

Avian malaria parasites (Plasmodium spp.) and related haemosporidians (Haemosporida) are responsible for diseases which can be severe and even lethal in avian hosts. These parasites cause not only blood pathology, but also damage various organs due to extensive exo-erythrocytic development all over the body, which is not the case during Plasmodium infections in mammals. However, exo-erythrocytic development (tissue merogony or schizogony) remains the most poorly investigated part of life cycle in all groups of wildlife haemosporidian parasites. In spite of remarkable progress in studies of genetic diversity, ecology and evolutionary biology of avian haemosporidians during the past 20 years, there is not much progress in understanding patterns of exo-erythrocytic development in these parasites. The purpose of this review is to overview the main information on exo-erythrocytic development of avian Plasmodium species and related haemosporidian parasites as a baseline for assisting academic and veterinary medicine researchers in morphological identification of these parasites using tissue stages, and to define future research priorities in this field of avian malariology. The data were considered from peer-reviewed articles and histological material that was accessed in zoological collections in museums of Australia, Europe and the USA. Articles describing tissue stages of avian haemosporidians were included from 1908 to the present. Histological preparations of various organs infected with the exo-erythrocytic stages of different haemosporidian parasites were examined. In all, 229 published articles were included in this review. Exo-erythrocytic stages of avian Plasmodium, Fallisia, Haemoproteus, Leucocytozoon, and Akiba species were analysed, compared and illustrated. Morphological characters of tissue stages that can be used for diagnostic purposes were specified. Recent molecular studies combined with histological research show that avian haemosporidians are more

Abnormal magnetization and field-induced transition in (La{sub 0.73}Bi{sub 0.27}){sub 0.67}Ca{sub 0.33}MnO{sub 3}

Energy Technology Data Exchange (ETDEWEB)

Li Haina; Wu Yuying [Department of Physics, Huazhong University of Science and Technology, Wuhan (China); Yu Hongwei [College of Science, Naval University of Engineering, Wuhan (China); Chen Ziyu [Department of Physics, Huazhong University of Science and Technology, Wuhan (China); Huang Yan; Wang Shaoliang; Li Liang [Wuhan Pulsed High Magnetic Field Center, Huazhong University of Science and Technology, Wuhan (China); Xia Zhengcai, E-mail: xia9020@hust.edu.c [Wuhan Pulsed High Magnetic Field Center, Huazhong University of Science and Technology, Wuhan (China)

2010-09-15

The magnetic field dependence of magnetization of Bi doped manganites (La{sub 1-x}Bi{sub x}){sub 0.67}Ca{sub 0.33}MnO{sub 3} (x=0.27) was investigated at different temperatures with a pulsed high magnetic field. A metamagnetic transition was observed in the magnetization measurement, which revealed the coexistence of charge ordering (CO) and ferromagnetic (FM) phases. With decreasing magnetic field, the field-induced FM phases remained stable even when the magnetic field decreased to zero. This result suggests that ferromagnetic interactions are enhanced due to the effect of the pulsed high magnetic field, which makes the doped manganites a good system for magnetoresistance materials.

Structural basis of cytotoxicity mediated by the type III secretion toxin ExoU from Pseudomonas aeruginosa.

Directory of Open Access Journals (Sweden)

Claire Gendrin

Full Text Available The type III secretion system (T3SS is a complex macromolecular machinery employed by a number of Gram-negative pathogens to inject effectors directly into the cytoplasm of eukaryotic cells. ExoU from the opportunistic pathogen Pseudomonas aeruginosa is one of the most aggressive toxins injected by a T3SS, leading to rapid cell necrosis. Here we report the crystal structure of ExoU in complex with its chaperone, SpcU. ExoU folds into membrane-binding, bridging, and phospholipase domains. SpcU maintains the N-terminus of ExoU in an unfolded state, required for secretion. The phospholipase domain carries an embedded catalytic site whose position within ExoU does not permit direct interaction with the bilayer, which suggests that ExoU must undergo a conformational rearrangement in order to access lipids within the target membrane. The bridging domain connects catalytic domain and membrane-binding domains, the latter of which displays specificity to PI(4,5P₂. Both transfection experiments and infection of eukaryotic cells with ExoU-secreting bacteria show that ExoU ubiquitination results in its co-localization with endosomal markers. This could reflect an attempt of the infected cell to target ExoU for degradation in order to protect itself from its aggressive cytotoxic action.

Superconducting transition in TlBiTe/sub 2/ and TlTe compounds

Energy Technology Data Exchange (ETDEWEB)

Kantser, V G; Popovich, N S; Sidorenko, A S

1985-10-01

On the basis of zone structure calculation for TlBiTe/sub 2/ and TlTe it is found that TlBiTe/sub 2/ is a narrow-gap semiconductor and TlTe is a p-metal. At Tsub(c)=0.19 K TlTe is found to experience the superconducting transition. In TlBiTe/sub 2/ superconductivity is not observed to occur up to 0.05 K, since there is a possibility of occupying the high density of states zones because they are remote from actual ones. The earlier discovered superconducting transition in TlBiTe/sub 2/ is inherent in the alien phase of TlTe.

Multiple magnetic transitions, dynamical magnetic liquid and magnetic glass in La{sub 1−x−y}Pr{sub y}Ca{sub x}MnO{sub 3} (x≈0.42, y≈0.40) thin films: A thickness dependent study

Energy Technology Data Exchange (ETDEWEB)

Agarwal, Vasudha; Kandpal, Lalit M.; Siwach, P.K.; Awana, V.P.S. [CSIR-National Physical Laboratory, Dr. K.S. Krishnan Marg, New Delhi 110012 (India); AcSIR at CSIR-National Physical Laboratory, Dr. K.S. Krishnan Marg, New Delhi 110012 (India); Singh, H.K., E-mail: hks65@nplindia.org [CSIR-National Physical Laboratory, Dr. K.S. Krishnan Marg, New Delhi 110012 (India); AcSIR at CSIR-National Physical Laboratory, Dr. K.S. Krishnan Marg, New Delhi 110012 (India)

2015-11-15

The influence of substrate induced strain and its relaxation on the evolution of the multiple magnetic transitions and ensuing modifications in the degree of phase separation, the nature of the dynamical magnetic liquid, the randomly frozen glass and insulator–metal transitions have been investigated in single crystalline La{sub 1−x−y}Pr{sub y}Ca{sub x}MnO{sub 3} (x≈0.42, y≈0.40) in t~20–140 nm thick films deposited on LaAlO{sub 3} (001) substrates. The ferromagnetic (FM) transition temperature (T{sub C}) first decreases as the film thickness is increased from t~20 nm to t~60 nm and then increases with increasing film thickness. In contrast the charge ordering (CO), antiferromagnetic (AFM) and glass transition temperatures shift towards higher values with increasing film thickness. The field cooled cooling (FCC) and field cooled warming (FCW) magnetization (M–T) of films having t≥60 nm shows pronounced hysteresis and ΔT{sub C}=T{sub C}{sup FCW}−T{sub C}{sup FCC} decreases concomitantly from 46 K to 35 K as the thickness increases from ~60 to ~140 nm. The thinnest film shows insulator to metal transitions (IMT) only at magnetic field H>40 kOe. Films with t≥T{sub C} show sharp hysteretic IMT, with ΔT{sub IM}=T{sub IM}{sup W}−T{sub IM}{sup C} decreasing from ~70 K to ~50 K as the thickness increases from ~60 nm to ~140 nm. Such strong hysteresis is a characteristic of first order phase transition and also a signature of magnetic liquid like phase created by the magnetic frustration created by the delicate balance between FM and AFM/CO phases. The H induced AFM/CO to FM transition reduces ΔT{sub IM} and at higher fields the phase transition appears akin to the second order. The observed difference in the magnetic and transport properties have been explained in terms of the substrate induced strain at lower film thickness and its relaxation at higher thickness. - Highlights: • Different thickness La{sub 1−x−y}Pr{sub y}Ca{sub x}MnO{sub 3

Combined action of the major secreted exo- and endopolygalacturonases is required for full virulence of Fusarium oxysporum.

Science.gov (United States)

Bravo Ruiz, Gustavo; Di Pietro, Antonio; Roncero, M Isabel G

2016-04-01

The genome of the tomato pathogen Fusarium oxysporum f. sp. lycopersici encodes eight different polygalacturonases (PGs): four endoPGs and four exoPGs. Quantitative real-time reverse transcription-polymerase chain reaction (RT-PCR) revealed that endoPGs pg1 and pg5 and exoPGs pgx4 and pgx6 are expressed at significant levels during growth on citrus pectin, polygalacturonic acid or the monomer galacturonic acid, as well as during the infection of tomato plants. The remaining PG genes exhibit low expression levels under all the conditions tested. Secreted PG activity was decreased significantly during growth on pectin in the single deletion mutants lacking either pg1 or pgx6, as well as in the double mutant. Although the single deletion mutants did not display a significant virulence reduction on tomato plants, the Δpg1Δpgx6 double mutant was significantly attenuated in virulence. The combined action of exoPGs and endoPGs is thus essential for plant infection by the vascular wilt fungus F. oxysporum. © 2015 BSPP and John Wiley & Sons Ltd.

The ternary post-transition metal carbodiimide SrZn(NCN){sub 2}

Energy Technology Data Exchange (ETDEWEB)

Corkett, Alex J.; Konze, Philipp M. [Institute of Inorganic Chemistry, RWTH Aachen University, Aachen (Germany); Dronskowski, Richard [Institute of Inorganic Chemistry, RWTH Aachen University, Aachen (Germany); Juelich-Aachen Research Alliance (JARA-HPC), RWTH-Aachen University, Aachen (Germany)

2017-11-17

SrZn(NCN){sub 2}, the first example of a ternary post-transition metal carbodiimide, was prepared by a solid-state metathesis reaction. The crystal structure was solved from PXRD data and found to adopt the orthorhombic (Cmcm) BaZnSO structure, a high symmetry modification of that expressed by the oxide analogue SrZnO{sub 2}. Locally, SrZn(NCN){sub 2} features ZnN{sub 4} tetrahedra and SrN{sub 6} trigonal prisms similar to those in quarternary LiSr{sub 2}M(NCN){sub 4} (M = Al{sup 3+} and Ga{sup 3+}) phases, however, the overall topologies are distinct with single chains in the former and double chains in the latter. Electronic structure calculations indicate an indirect bandgap of about 2.95 eV in SrZn(NCN){sub 2}, slightly lower than the experimentally observed bandgap of 3.4 eV in SrZnO{sub 2} and consistent with a greater degree of covalency. The structural similarities between SrZn(NCN){sub 2} and oxychalcogenide analogues highlight the pseudochalcogenide character of NCN{sup 2-} and suggest that the title compound may serve as a template for accessing novel ternary carbodiimides featuring tetrahedrally coordinated transition metals. (copyright 2017 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

Spin transitions in La{sub 0.7} Ba{sub 0.3}CoO{sub 3} thin films revealed by combining Raman spectroscopy and X-ray diffraction

Energy Technology Data Exchange (ETDEWEB)

Othmen, Zied; Oueslati, Meherzi [Unité Nanomatériaux et Photonique, Faculty of Sciences of Tunis, Tunis El-Manar University, 2092 Tunis (Tunisia); Copie, Olivier; Gemeiner, Pascale; Dkhil, Brahim [Laboratoire Structures, Propriétés et Modélisation des Solides, Centrale Supélec, CNRS-UMR 8580, Université Paris-Saclay (France); Daoudi, Kais [Unité Nanomatériaux et Photonique, Faculty of Sciences of Tunis, Tunis El-Manar University, 2092 Tunis (Tunisia); Department of Applied Physics and Astronomy, College of Sciences, University of Sharjah, P.O. Box 27272, Sharjah (United Arab Emirates); Boudard, Michel [Univ. Grenoble Alpes, LMGP, F-38000 Grenoble (France)

2016-07-07

In cobaltite, the spin states transitions of Co{sup 3+/4+} ions govern the magnetic and electronic conduction properties. These transitions are strain-sensitive and can be varied using external parameters, including temperature, hydrostatic pressure, or chemical stresses through ionic substitutions. In this work, using temperature dependent Raman spectroscopy and X-ray diffraction, the epitaxial strain effects on both structural and vibrational properties of La{sub 0.7} Ba{sub 0.3} CoO{sub 3} (LBCO) cobaltite thin films are investigated. All Raman active phonon modes as well as the structure are found to be strongly affected. Both Raman modes and lattice parameter evolutions show temperature changes correlated with magnetic and electronic transitions properties. Combining Raman spectroscopy and X-ray diffraction appears as a powerful approach to probe the spin transition in thin film cobaltite. Our results provide insight into strong spin-charge-phonon coupling in LBCO thin film. This coupling manifests as vibrational transition with temperature in the Raman spectra near the ferromagnetic spin ordered transition at 220 K.

Effect of gold subsurface layer on the surface activity and segregation in Pt/Au/Pt{sub 3}M (where M = 3d transition metals) alloy catalyst from first-principles

Energy Technology Data Exchange (ETDEWEB)

Kim, Chang-Eun [Fuel Cell Research Center, Korea Institute of Science and Technology (KIST), 39-1 Hawolgok, Seongbuk-gu, Seoul 136-791 (Korea, Republic of); Global E3 Institute and Department of Materials Science and Engineering, Yonsei University, 120-749 Seoul (Korea, Republic of); Lim, Dong-Hee [Fuel Cell Research Center, Korea Institute of Science and Technology (KIST), 39-1 Hawolgok, Seongbuk-gu, Seoul 136-791 (Korea, Republic of); Department of Environmental Engineering, Chungbuk National University, 1 Chungdae-ro, Seowon-Gu, Cheongju, Chungbuk 362-763 (Korea, Republic of); Jang, Jong Hyun; Kim, Hyoung Juhn; Yoon, Sung Pil; Han, Jonghee; Nam, Suk Woo [Fuel Cell Research Center, Korea Institute of Science and Technology (KIST), 39-1 Hawolgok, Seongbuk-gu, Seoul 136-791 (Korea, Republic of); Hong, Seong-Ahn [Fuel Cell Research Center, Korea Institute of Science and Technology (KIST), 39-1 Hawolgok, Seongbuk-gu, Seoul 136-791 (Korea, Republic of); Department of Advanced Materials Chemistry, Korea University, Sejong-city 339-700 (Korea, Republic of); Soon, Aloysius, E-mail: aloysius.soon@yonsei.ac.kr, E-mail: hchahm@kist.re.kr [Global E3 Institute and Department of Materials Science and Engineering, Yonsei University, 120-749 Seoul (Korea, Republic of); Ham, Hyung Chul, E-mail: aloysius.soon@yonsei.ac.kr, E-mail: hchahm@kist.re.kr [Fuel Cell Research Center, Korea Institute of Science and Technology (KIST), 39-1 Hawolgok, Seongbuk-gu, Seoul 136-791 (Korea, Republic of); Clean Energy and Chemical Engineering, University of Science and Technology (UST), 217 Gajungro, Yuseong-gu, Daejeon 305-333 (Korea, Republic of)

2015-01-21

The effect of a subsurface hetero layer (thin gold) on the activity and stability of Pt skin surface in Pt{sub 3}M system (M = 3d transition metals) is investigated using the spin-polarized density functional theory calculation. First, we find that the heterometallic interaction between the Pt skin surface and the gold subsurface in Pt/Au/Pt{sub 3}M system can significantly modify the electronic structure of the Pt skin surface. In particular, the local density of states projected onto the d states of Pt skin surface near the Fermi level is drastically decreased compared to the Pt/Pt/Pt{sub 3}M case, leading to the reduction of the oxygen binding strength of the Pt skin surface. This modification is related to the increase of surface charge polarization of outmost Pt skin atoms by the electron transfer from the gold subsurface atoms. Furthermore, a subsurface gold layer is found to cast the energetic barrier to the segregation loss of metal atoms from the bulk (inside) region, which can enhance the durability of Pt{sub 3}M based catalytic system in oxygen reduction condition at fuel cell devices. This study highlights that a gold subsurface hetero layer can provide an additional mean to tune the surface activity toward oxygen species and in turn the oxygen reduction reaction, where the utilization of geometric strain already reaches its practical limit.

The role of Ca substitution on the nature of the superconducting transition of YBa{sub 2}Cu{sub 3}O{sub 7-{delta}}

Energy Technology Data Exchange (ETDEWEB)

Jaeckel, S.T.; Lopes, L.F.; Nunes, S.E.; Mendonca, A.P.A.; Lopes, R.F.; Vieira, V.N. [Universidade Federal de Pelotas, RS (Brazil). Inst. de Fisica e Matematica; Pureur, P.; Pimentel Junior, J.L.; Rosa, F.M. [Universidade Federal do Rio Grande do Sul (UFRGS), Porto Alegre, RS (Brazil). Inst. de Fisica; Ferreira, L.M. [Universidade Federal do ABC (UFABC), Santo Andre, SP (Brazil). Centro de Ciencias Naturais e Humanas

2012-07-01

Full text: In this work we report the results of an experimental study about the superconducting transition of Ca- doped YBa{sub 2}Cu{sub 3}O{sub 7-{delta}}samples. Temperature dependent in-plane resistivity measurements were carried out on Y{sub 1-x}Ca{sub x}Ba{sub 2}Cu{sub 3}O{sub 7-{delta}} single crystals with Ca content x = 0, 0.01, 0.05, 0.10. The samples were studied under hydrostatic pressure conditions (P {<=}15 kbar) and applied magnetic fields (H {<=} 2500 Oe) with H parallel to the c-axis. From the analysis of the contribution of superconducting fluctuations to the electrical conductivity we identified a fluctuation regime described by the small exponent {lambda}{sub cr} = 0.20 in a narrow temperature range immediately above the critical temperature. The origin of this fluctuation regime is still unclear. A possibility is that it may be a precursor to a weakly first-order pairing transition. The evolution of this super-critical regime with pressure and magnetic field for our Ca-doped samples is distinct from results reported in the literature for pure and other divalent substituted YBa{sub 2}Cu{sub 3}O{sub 7-{delta}}samples. Our results indicate that Ca doping favors the stabilization of the super-critical regime. (author)

M<sub>5sub>Si>3sub>(M=Ti, Nb, Mo) Based Transition-Metal Silicides for High Temperature Applications

Energy Technology Data Exchange (ETDEWEB)

Tang, Zhihong [Iowa State Univ., Ames, IA (United States)

2007-01-01

Transition metal silicides are being considered for future engine turbine components at temperatures up to 1600 C. Although significant improvement in high temperature strength, room temperature fracture toughness has been realized in the past decade, further improvement in oxidation resistance is needed. Oxidation mechanism of Ti<sub>5sub>Si>3sub>-based alloys was investigated. Oxidation behavior of Ti<sub>5sub>Si>3sub>-based alloy strongly depends on the atmosphere. Presence of Nitrogen alters the oxidation behavior of Ti<sub>5sub>Si>3sub> by nucleation and growth of nitride subscale. Ti<sub>5sub>Si>3.2sub>and Ti<sub>5sub>Si>3sub>C>0.5sub> alloys exhibited an excellent oxidation resistance in nitrogen bearing atmosphere due to limited dissolution of nitrogen and increased Si/Ti activity ratio. MoSi<sub>2sub> coating developed by pack cementation to protect Mo-based Mo-Si-B composites was found to be effective up to 1500 C. Shifting coating composition to T1+T2+Mo<sub>3sub>Si region showed the possibility to extend the coating lifetime above 1500 C by more than ten times via formation of slow growing Mo<sub>3sub>Si or T2 interlayer without sacrificing the oxidation resistance of the coating. The phase equilibria in the Nb-rich portion of Nb-B system has been evaluated experimentally using metallographic analysis and differential thermal analyzer (DTA). It was shown that Nb<sub>ss> (solid solution) and NbB are the only two primary phases in the 0-40 at.% B composition range, and the eutectic reaction L {leftrightarrow} Nb<sub>SS> + NbB was determined to occur at 2104 ± 5 C by DTA.

What Can the Redshift Observed in EXO 0748-676 Tell Us?

Institute of Scientific and Technical Information of China (English)

无

2003-01-01

The mass-radius relations for bare and crusted strange stars are calcu-lated with the bag model. Comparing these relations with the observed one derivedfrom the redshift of EXO 0748-676, we come to the conclusion that it is incorrectto say that EXO 0748-676 cannot be a strange star. Various strange star modelscan show that EXO 0748-676 could have a mass of (1.3 ～ 1.7) M and a radius of(8.4 ～ 11.4) km. It is proposed that a proportion of nascent strange stars could bebare and have masses ～ 0.1 M , and their masses increased over a long period ofaccretion.

Fingerprints of field-induced Berezinskii–Kosterlitz–Thouless transition in quasi-two-dimensional S=1/2 Heisenberg magnets Cu(en)(H{sub 2}O){sub 2}SO{sub 4} and Cu(tn)Cl{sub 2}

Energy Technology Data Exchange (ETDEWEB)

Baranová, Lucia [Civil Engineering Faculty, Department of Applied Mathematics, Technical University of Košice, Vysokoškolská 4 SK-042 00, Košice (Slovakia); Orendáčová, Alžbeta, E-mail: alzbeta.orendacova@upjs.sk [Center of Low Temperature Physics, Faculty of Science, P. J. Šafárik University, Park Angelinum 9 SK-041 54, Košice (Slovakia); Čižmár, Erik [Center of Low Temperature Physics, Faculty of Science, P. J. Šafárik University, Park Angelinum 9 SK-041 54, Košice (Slovakia); Tarasenko, Róbert; Tkáč, Vladimír [Center of Low Temperature Physics, Faculty of Science, P. J. Šafárik University, Park Angelinum 9 SK-041 54, Košice (Slovakia); Charles University, Faculty of Mathematics and Physics, Ke Karlovu 5 12116, Prague (Czech Republic); Orendáč, Martin; Feher, Alexander [Center of Low Temperature Physics, Faculty of Science, P. J. Šafárik University, Park Angelinum 9 SK-041 54, Košice (Slovakia)

2016-04-15

Organo-metallic compounds Cu(en)(H{sub 2}O){sub 2}SO{sub 4} (en=C{sub 2}H{sub 8}N{sub 2}) and Cu(tn)Cl{sub 2} (tn=C{sub 3}H{sub 10}N{sub 2}) representing S=1/2 quasi-two-dimensional Heisenberg antiferromagnets with an effective intra-layer exchange coupling J/k{sub B}≈3 K, have been examined by specific heat measurements at temperatures down to nominally 50 mK and magnetic fields up to 14 T. A comparative analysis of magnetic specific heat in zero magnetic field revealed nearly identical contribution of short-range magnetic correlations and significant differences were observed at lowest temperatures. A phase transition to long-range order was observed in Cu(en)(H{sub 2}O){sub 2}SO{sub 4} at T{sub C}=0.9 K while hidden in Cu(tn)Cl{sub 2}. A response of both compounds to the application of magnetic field has rather universal features characteristic for a field-induced Berezinskii–Kosterlitz–Thouless transition theoretically predicted for ideal two-dimensional magnets. - Highlights: • Magnetic specific heat of Cu(en)(H{sub 2}O){sub 2}SO{sub 4} (1) and Cu(tn)Cl{sub 2} (2) was analysed. • In zero magnetic field, (1) and (2) behave as quasi-two-dimensional magnets. • We observed universal thermodynamic response of (1) and (2) to applied field. • Features of field-induced Berezinskii–Kosterlitz–Thouless transition were detected.

Low temperature phase transition and crystal structure of CsMgPO{sub 4}

Energy Technology Data Exchange (ETDEWEB)

Orlova, Maria, E-mail: maria.p.orlova@gmail.com [Institute of Mineralogy and Petrography, University of Innsbruck, Innrain 52, Innsbruck 6020 (Austria); Khainakov, Sergey [Departamento de Química Física y Analítica, Universidad de Oviedo—CINN, 33006 Oviedo (Spain); Servicios Científico Técnicos, Universidad de Oviedo, 33006 Oviedo (Spain); Michailov, Dmitriy [Department of Chemistry, University of Nizhny Novgorod, 23 Gagarin av., Nizhny Novgorod 603950 (Russian Federation); Perfler, Lukas [Institute of Mineralogy and Petrography, University of Innsbruck, Innrain 52, Innsbruck 6020 (Austria); Langes, Christoph [Institute of Pharmacy, University of Innsbruck, Innrain 52, Innsbruck 6020 (Austria); Kahlenberg, Volker [Institute of Mineralogy and Petrography, University of Innsbruck, Innrain 52, Innsbruck 6020 (Austria); Orlova, Albina [Department of Chemistry, University of Nizhny Novgorod, 23 Gagarin av., Nizhny Novgorod 603950 (Russian Federation)

2015-01-15

CsMgPO{sub 4} doped with radioisotopes is a promising compound for usage as a radioactive medical source. However, a low temperature phase transition at temperatures close to ambient conditions (∼−40 °C) was observed. Information about such kind of structural changes is important in order to understand whether it can cause any problem for medical use of this compound. The phase transition has been investigated in detail using synchrotron powder diffraction, Raman spectroscopy and DFT calculations. The structure undergoes a transformation from an orthorhombic modification, space group Pnma (RT phase) to a monoclinic polymorph, space group P2{sub 1}/n (LT phase). New LT modification adopts similar to RT but slightly distorted unit cell: a=9.58199(2) Å, b=8.95501(1) Å, c=5.50344(2) Å, β=90.68583(1)°, V=472.198(3) Å{sup 3}. CsMgPO{sub 4} belongs to the group of framework compounds and is made up of strictly alternating MgO{sub 4}- and PO{sub 4}-tetrahedra sharing vertices. The cesium counter cations are located in the resulting channel-like cavities. Upon the transformation a combined tilting of the tetrahedra is observed. A comparison with other phase transitions in ABW-type framework compounds is given. - Graphical abstract: Structural behavior of β-tridymite-type phosphate CsMgPO{sub 4}, considered as potential chemical form for radioactive Cs-source has been studied at near ambient temperatures. A phase transition at (∼−40 °C) has been found and investigated. It has been established that the known orthorhombic RT modification, space group Pnma, adopts a monoclinic cell with space group P2{sub 1}/n at low temperatures. In this paper, we present results of structural analysis of changes accompanying this phase transition and discuss its possible impact on the application properties. - Highlights: • β-Tridymite type phosphate CsMgPO{sub 4} undergoes so called translationengleiche phase transition of index 2 at −40 °C. • The structure

Levels and Transition Rates in {sup 199}Au

Energy Technology Data Exchange (ETDEWEB)

Malmskog, S G; Baecklin, A; Fogelberg, B

1967-10-15

The decay of {sup 199}Pt to {sup 199}Au (T{sub 1/2} = 30.8 min) has been investigated using a Ge(Li) detector and a double focusing beta spectrometer. 34 transitions were found and multipolarities were assigned for 11 of these, including a 55.15 keV M2 + (0.9 {+-} 0.5) % E3 isomeric transition. Using these data together with the results of {gamma}-{gamma} and {beta}-{gamma} coincidence measurements, a decay scheme containing 9 excited levels and 25 transitions was constructed and spin and parity assignments were made. Using the delayed coincidence technique half-lives were determined for 3 levels and upper limits were obtained for 5 additional levels. The following levels were found: 77.21 {+-} 0.03 keV (1/2{sup +}, 1.1 {+-} 0.1 ns ); 316.98 {+-} 0.10 (5/2{sup +}, < 55 ps); 323.57 {+-}0.09 keV ((1/2), 3/2{sup +}, 35 {+-}20 ps); 493.59 {+-}0.10 keV (7/2{sup +}, < 35 ps ) ; 542.82 {+-} 0.07 keV (5/2{sup +}, < 30 ps ) ; 548.65 {+-} 0.09 keV (11/2{sup -}); 734.44 {+-}0.11 keV (7/2{sup -}, 0.36 {+-} 0.04 ns); 791.47 {+-} 0.15 keV (3/2{sup +}, 5/2{sup +}, < 50 ps); and 967.98 {+-} 0.20 keV (3/2{sup (+)}, 5/2{sup (+)}, < 100 ps ). The decay properties of the lowest excited positive parity levels are discussed in terms of de-Shalit's core excitation model.

Infield X-ray diffraction studies of field and temperature driven structural phase transition in Nd{sub 0.49}Sr{sub 0.51}MnO{sub 3+δ}

Energy Technology Data Exchange (ETDEWEB)

Shahee, Aga, E-mail: agashahee@gmail.com [UGC-DAE Consortium for Scientific Research, University Campus, Khandwa Road, Indore 452001 (India); Department of Physics, IIT Bombay, Powai, Mumbai 400076 (India); Sharma, Shivani; Singh, K.; Lalla, N.P. [UGC-DAE Consortium for Scientific Research, University Campus, Khandwa Road, Indore 452001 (India)

2017-07-15

Highlights: • Temperature and magnetic field driven coupled magneto-structural phase transition in Nd{sub 0.49}Sr{sub 0.51}MnO{sub 3+δ}. • Microscopic evidence of strong spin-charge-lattice coupling. • Iso-thermal magnetic field driven structure phase transition. • Field-driven structural phase transition origin of observed 1st order type CMR effect. - Abstract: Comprehensive X-ray diffraction (XRD) studies have been performed at different temperature (T) (4.2–300 K) and magnetic field (H) (0–8 T) to understand the evolution of crystal structure of Nd{sub 0.49}Sr{sub 0.51}MnO{sub 3+δ} (NSMO) under non ambient conditions. The T dependent XRD results show the abrupt change in the lattice parameters without any change in lattice symmetry at ∼200 K, which is associated with the first order structural phase transition from ferromagnetic to antiferromagnetic phase. This phase transition is strongly H dependent and shifted to lower temperature (∼150 K) on the application of 8 T field with phase coexistence (high temperature phase ∼18%), even down to 4.2 K. Isothermal XRD results at 150 K under different H clearly illustrate the H induced first order structural phase transition. The critical H at which this phase transformation starts is ∼1 T, with rapid growth above 4 T with hysteretic nature during increasing and decreasing H. These results are supported with the resistivity and magnetoresistance results and affirm the strong spin-lattice coupling in NSMO. Our detail studies reveal the structural correlations to the observed colossal magnetoresistance and magnetocaloric effect in this material.

ExoMol molecular line lists - XXVII: spectra of C2H4

Science.gov (United States)

Mant, Barry P.; Yachmenev, Andrey; Yurchenko, Jonathan Tennyson Sergei N.

2018-05-01

A new line list for ethylene, 12C21H4 is presented. The line list is based on high level ab initiopotential energy and dipole moment surfaces. The potential energy surface is refined by fitting to experimental energies. The line list covers the range up to 7000 cm-1(1.43 μm) with all ro-vibrational transitions (50 billion) with the lower state below 5000 cm-1included and thus should be applicable for temperatures up to 700 K. A technique for computing molecular opacities from vibrational band intensities is proposed and used to provide temperature dependent cross sections of ethylene for shorter wavelength and higher temperatures. When combined with realistic band profiles (such as the proposed three-band model), the vibrational intensity technique offers a cheap but reasonably accurate alternative to the full ro-vibrational calculations at high temperatures and should be reliable for representing molecular opacities. The C2H4 line list, which is called MaYTY, is rmade available in electronic form from the CDS (http://cdsarc.u-strasbg.fr) and ExoMol (www.exomol.com) databases.

Enthalpies of formation of layered LiNi{sub x}Mn{sub x}Co{sub 1-2x}O{sub 2} (0 ≤ x ≤ 0.5) compounds as lithium ion battery cathode materials

Energy Technology Data Exchange (ETDEWEB)

Masoumi, Maryam; Cupid, Damian M.; Reichmann, Thomas L.; Seifert, Hans J. [Karlsruhe Institute of Technology, Eggenstein-Leopoldshafen (Germany). Inst. for Applied Materials - Applied Materials Physics; Chang, Keke; Music, Denis; Schneider, Jochen M. [RWTH Aachen Univ. (Germany). Materials Chemistry

2017-11-15

Layer-structured mixed transition metal oxides with the formula LiNi{sub x}Mn{sub x}Co{sub 1-2x}O{sub 2} (0 ≤ x ≤ 0.5) are considered as important cathode materials for lithium-ion batteries. In an effort to evaluate the relative thermodynamic stabilities of individual compositions in this series, the enthalpies of formation of selected stoichiometries are determined by high temperature oxide melt drop solution calorimetry and verified by ab-initio calculations. The measured and calculated data are in good agreement with each other, and the results show that LiCoO{sub 2}-LiNi{sub 0.5}Mn{sub 0.5}O{sub 2} solid solution approaches ideal behavior. By increasing x, i.e. by equimolar substitution of Mn{sup 4+} and Ni{sup 2+} for Co{sup 3+}, the enthalpy of formation of LiNi{sub x}Mn{sub x}Co{sub 1-2x}O{sub 2} from the elements becomes more exothermic, implying increased energetic stability. This conclusion is in agreement with the literature results showing improved structural stability and cycling performance of Ni/Mn-rich LiNi{sub x}Mn{sub x}Co{sub 1-2x}O{sub 2} compounds cycled to higher cut-off voltages.

Phase transformation in multiferroic Bi{sub 5}Ti{sub 3}FeO{sub 15} ceramics by temperature-dependent ellipsometric and Raman spectra: An interband electronic transition evidence

Energy Technology Data Exchange (ETDEWEB)

Jiang, P. P.; Duan, Z. H.; Xu, L. P.; Zhang, X. L.; Li, Y. W.; Hu, Z. G., E-mail: zghu@ee.ecnu.edu.cn; Chu, J. H. [Key Laboratory of Polar Materials and Devices, Ministry of Education, Department of Electronic Engineering, East China Normal University, Shanghai 200241 (China)

2014-02-28

Thermal evolution and an intermediate phase between ferroelectric orthorhombic and paraelectric tetragonal phase of multiferroic Bi{sub 5}Ti{sub 3}FeO{sub 15} ceramic have been investigated by temperature-dependent spectroscopic ellipsometry and Raman scattering. Dielectric functions and interband transitions extracted from the standard critical-point model show two dramatic anomalies in the temperature range of 200–873 K. It was found that the anomalous temperature dependence of electronic transition energies and Raman mode frequencies around 800 K can be ascribed to intermediate phase transformation. Moreover, the disappearance of electronic transition around 3 eV at 590 K is associated with the conductive property.

EXOS research on master controllers for robotic devices

Science.gov (United States)

Marcus, Beth A.; An, Ben; Eberman, Brian

1992-01-01

Two projects are currently being conducted by EXOS under the Small Business Innovation Research (SBIR) program with NASA. One project will develop a force feedback device for controlling robot hands, the other will develop an elbow and shoulder exoskeleton which can be integrated with other EXOS devices to provide whole robot arm and hand control. Aspects covered are the project objectives, important research issues which have arisen during the developments, and interim results of the projects. The Phase 1 projects currently underway will result in hardware prototypes and identification of research issues required for complete system development and/or integration.

Pressure-induced Td to 1T′ structural phase transition in WTe{sub 2}

Energy Technology Data Exchange (ETDEWEB)

Zhou, Yonghui [High Magnetic Field Laboratory, Chinese Academy of Sciences, Hefei 230031 (China); Key Laboratory of Materials Physics, Institute of Solid State Physics, Chinese Academy of Sciences, Hefei 230031 (China); Chen, Xuliang, E-mail: xlchen@hmfl.ac.cn, E-mail: zryang@issp.ac.cn; Zhang, Ranran; Wang, Xuefei; An, Chao; Zhou, Ying [High Magnetic Field Laboratory, Chinese Academy of Sciences, Hefei 230031 (China); Li, Nana [Center for High Pressure Science and Technology Advanced Research, Shanghai 201203 (China); Pan, Xingchen [National Laboratory of Solid State Microstructures, College of Physics, Nanjing University, Nanjing 210093 (China); Song, Fengqi; Wang, Baigeng [National Laboratory of Solid State Microstructures, College of Physics, Nanjing University, Nanjing 210093 (China); Collaborative Innovation Center of Advanced Microstructures, Nanjing University, Nanjing 210093 (China); Yang, Wenge [Center for High Pressure Science and Technology Advanced Research, Shanghai 201203 (China); High Pressure Synergetic Consortium, Geophysical Laboratory, Carnegie Institution of Washington, Argonne, IL 60439 (United States); Yang, Zhaorong, E-mail: xlchen@hmfl.ac.cn, E-mail: zryang@issp.ac.cn [High Magnetic Field Laboratory, Chinese Academy of Sciences, Hefei 230031 (China); Key Laboratory of Materials Physics, Institute of Solid State Physics, Chinese Academy of Sciences, Hefei 230031 (China); Collaborative Innovation Center of Advanced Microstructures, Nanjing University, Nanjing 210093 (China); Zhang, Yuheng [High Magnetic Field Laboratory, Chinese Academy of Sciences, Hefei 230031 (China); Collaborative Innovation Center of Advanced Microstructures, Nanjing University, Nanjing 210093 (China)

2016-07-15

WTe{sub 2} is provoking immense interest owing to its extraordinary properties, such as large positive magnetoresistance, pressure-driven superconductivity and possible type-II Weyl semimetal state. Here we report results of high-pressure synchrotron X-ray diffraction (XRD), Raman and electrical transport measurements on WTe{sub 2}. Both the XRD and Raman results reveal a structural transition upon compression, starting at 6.0 GPa and completing above 15.5 GPa. We have determined that the high-pressure lattice symmetry is monoclinic 1T′ with space group of P2{sub 1}/m. This transition is related to a lateral sliding of adjacent Te-W-Te layers and results in a collapse of the unit cell volume by ∼20.5%. The structural transition also casts a pressure range with the broadened superconducting transition, where the zero resistance disappears.

Electronic transport and conduction mechanism transition in La{sub 1∕3}Sr{sub 2∕3}FeO{sub 3} thin films

Energy Technology Data Exchange (ETDEWEB)

Devlin, R. C.; Krick, A. L.; Sichel-Tissot, R. J.; Xie, Y. J.; May, S. J., E-mail: smay@coe.drexel.edu [Department of Materials Science and Engineering, Drexel University, Philadelphia, Pennsylvania 19104 (United States)

2014-06-21

We report on the electronic transport properties of epitaxial La{sub 1∕3}Sr{sub 2∕3}FeO{sub 3} films using temperature dependent resistivity, Hall effect, and magnetoresistance measurements. We show that the electronic phase transition, which occurs near 190 K, results in a change in conduction mechanism from nonadiabatic polaron transport at high temperatures to resistivity behavior following a power law temperature dependence at low temperatures. The phase transition is also accompanied by an abrupt increase in apparent mobility and Hall coefficient below the critical temperature (T*). We argue that the exotic low temperature transport properties are a consequence of the unusually long-range periodicity of the antiferromagnetic ordering, which also couples to the electronic transport in the form of a negative magnetoresistance below T* and a sign reversal of the Hall coefficient at T*. By comparing films of differing thicknesses, stoichiometry, and strain states, we demonstrate that the observed conduction behavior is a robust feature of La{sub 1∕3}Sr{sub 2∕3}FeO{sub 3}.

Band mixing and electric monopole contribution in 2sub(. gamma. ). -->. 2sub(g) transition in /sup 168/Er

Energy Technology Data Exchange (ETDEWEB)

Sahota, H S; Hasiza, M L; Mittal, R [Punjabi Univ., Patiala (India). Dept. of Physics

1976-06-01

The 2sub(..gamma..)..-->..2sub(g) transition in /sup 168/Er has been examined for the presence of electric monopole contribution. The experimental E0/E2 reduced transition probabilities and monopole matrix element have been found to be somewhat larger than the theoretical predictions of the Bohr-Mottelson model but the ratio rhosup(2)/X has been found to agree well with the theoretical value. The band mixing parameters have also been evaluated and found to be sizeable.

Microstructure study of the rare-earth intermetallic compounds R<sub>5sub>(Si_xGe>1-xsub>)>4sub> and R<sub>5sub>(Si_xGe>1-xsub>)>3sub>

Energy Technology Data Exchange (ETDEWEB)

Cao, Qing [Iowa State Univ., Ames, IA (United States)

2012-01-01

The unique combination of magnetic properties and structural transitions exhibited by many members of the R<sub>5sub>(Si_xGe>1-xsub>)>4sub> family (R = rare earths, 0 ≤ x ≤ 1) presents numerous opportunities for these materials in advanced energy transformation applications. Past research has proven that the crystal structure and magnetic ordering of the R<sub>5sub>(Si_xGe>1-xsub>)>4sub> compounds can be altered by temperature, magnetic field, pressure and the Si/Ge ratio. Results of this thesis study on the crystal structure of the Er<sub>5sub>Si>4sub> compound have for the first time shown that the application of mechanical forces (i.e. shear stress introduced during the mechanical grinding) can also result in a structural transition from Gd<sub>5sub>Si>4sub>-type orthorhombic to Gd<sub>5sub>Si>2sub>Ge>2sub>-type monoclinic. This structural transition is reversible, moving in the opposite direction when the material is subjected to low-temperature annealing at 500 °C.

Correlation of Frequency of Pseudomonas Aeruginosa and Exos & Exou Genes and Their Antibiotic Sensitivity Pattern in Specimen Isolated from ICU Ward

Directory of Open Access Journals (Sweden)

Mahsa Joodzadeh

2016-06-01

Full Text Available Pseudomonas aeruginosa is a cause of nosocomial infections that can be destroyer by antibiotic-resistant strains. This study conducted to determine the antibiotic susceptibility pattern and distribution of exoU and exoS among clinical isolates of P. aeruginosa. Fifty three specimens of tracheal tube were collected from patients who were hospitalized in ICU wards and P. aeruginosa were isolated and identified by phenotypic and molecular methods. Antibiotic resistance performs by disk diffusion and analyzed their virulence factors genes by PCR method. Susceptibility pattern of 53 isolates of P. aeruginosa showed that majority and minority of resistance belong to cefepime (55.4%,and Meropenem (50% Respectively. Twenty four (45.2% isolates were not susceptible to three or more different groups of antibiotics. Forty (71.4% of isolated have had exoSand1(1.8% exoU, 8(15%both of exoS and exoU and the rest being negative for exoS or exoU. Distribution of MDR(resistance to three or more group of antibiotics exoenzymes were shown: exoU(7.5%and exoS(90.5%. According to statistically analysis there were not significant relationship between presence of exo SandexoU and antibiotic resistance.

Estimating heats of detonation and detonation velocities of aromatic energetic compounds

Energy Technology Data Exchange (ETDEWEB)

Keshavarz, Mohammad Hossein [Department of Chemistry, Malek-ashtar University of Technology, Shahin-shahr, P. O. Box 83145/115 (Iran)

2008-12-15

A new method is introduced to predict reliable estimation of heats of detonation of aromatic energetic compounds. At first step, this procedure assumes that the heat of detonation of an explosive compound of composition C{sub a}H{sub b}N{sub c}O{sub d} can be approximated as the difference between the heat of formation of all H{sub 2}O-CO{sub 2} arbitrary (H{sub 2}O, CO{sub 2}, N{sub 2}) detonation products and that of the explosive, divided by the formula weight of the explosive. Overestimated results based on (H{sub 2}O-CO{sub 2} arbitrary) can be corrected in the next step. Predicted heats of detonation of pure energetic compounds with the product H{sub 2}O in the liquid state for 31 aromatic energetic compounds have a root mean square (rms) deviation of 2.08 and 0.34 kJ g{sup -1} from experiment for (H{sub 2}O-CO{sub 2} arbitrary) and new method, respectively. The new method also gives good results as compared to the second sets of decomposition products, which consider H{sub 2},N{sub 2}, H{sub 2}O,CO, and CO{sub 2} as major gaseous products. It is shown here how the predicted heats of detonation by the new method can be used to obtain reliable estimation of detonation velocity over a wide range of loading densities. (Abstract Copyright [2008], Wiley Periodicals, Inc.)

Infrared reflectivity investigation of the phase transition sequence in Pr{sub 0.5}Ca{sub 0.5}MnO{sub 3}

Energy Technology Data Exchange (ETDEWEB)

Ribeiro, J.L., E-mail: jlr@fisica.uminho.pt [Centro and Departamento de Física da Universidade do Minho, Campus de Gualtar, 4710-057 Braga (Portugal); Vieira, L.G. [Centro and Departamento de Física da Universidade do Minho, Campus de Gualtar, 4710-057 Braga (Portugal); Gomes, I.T. [Centro and Departamento de Física da Universidade do Minho, Campus de Gualtar, 4710-057 Braga (Portugal); IFIMUP and IN - Institute of Nanoscience and Nanotechnology, Departamento de Física e Astronomia da Faculdade de Ciências da Universidade do Porto, R. do Campo Alegre, 687, 4769-007 Porto (Portugal); Araújo, J.P. [IFIMUP and IN - Institute of Nanoscience and Nanotechnology, Departamento de Física e Astronomia da Faculdade de Ciências da Universidade do Porto, R. do Campo Alegre, 687, 4769-007 Porto (Portugal); Tavares, P. [Centro de Química – Vila Real, Universidade de Trás-os-Montes e Alto Douro, 5001-801 Vila Real (Portugal); Almeida, B.G. [Centro and Departamento de Física da Universidade do Minho, Campus de Gualtar, 4710-057 Braga (Portugal)

2016-06-15

This work reports an infrared reflectivity study of the phase transition sequence observed in Pr{sub 0.5}Ca{sub 0.5}MnO{sub 3.} The need to measure over an extended spectral range in order to properly take into account the effects of the high frequency polaronic absorption is circumvented by adopting a simple approximate method, based on the asymmetry present in the Kramers Kronig inversion of the phonon spectrum. The temperature dependence of the phonon optical conductivity is then investigated by monitoring the behavior of three relevant spectral moments of the optical conductivity. This combined methodology allows us to disclose subtle effects of the orbital, charge and magnetic orders on the lattice dynamics of the compound. The characteristic transition temperatures inferred from the spectroscopic measurements are compared and correlated with those obtained from the temperature dependence of the induced magnetization and electrical resistivity. - Highlights: • Study of the effects of orbital, charge and spin orders on the lattice dynamics. • Phonon optical conductivity spectral moments are used to monitor phase transitions. • Precursor effects of the AFM order are detected by infrared spectroscopy.

Abrupt symmetry decrease in the ThT{sub 2}Al{sub 20} alloys (T = 3d transition metal)

Energy Technology Data Exchange (ETDEWEB)

Uziel, A.; Bram, A.I. [Department of Materials Engineering, Ben-Gurion University of the Negev, Beer-Sheva, 8410501 (Israel); Ilse Katz Institute for Nanoscale Science and Technology, Ben-Gurion University of the Negev, Beer-Sheva, 8410501 (Israel); Venkert, A. [Nuclear Research Center-Negev, POB 9001, Beer-Sheva (Israel); Kiv, A.E.; Fuks, D. [Department of Materials Engineering, Ben-Gurion University of the Negev, Beer-Sheva, 8410501 (Israel); Meshi, L., E-mail: louisa@bgu.ac.il [Department of Materials Engineering, Ben-Gurion University of the Negev, Beer-Sheva, 8410501 (Israel); Ilse Katz Institute for Nanoscale Science and Technology, Ben-Gurion University of the Negev, Beer-Sheva, 8410501 (Israel)

2015-11-05

Th-T-Al system, where T-3d transition metals, was studied at ThT{sub 2}Al{sub 20} stoichiometry to establish the influence of T on the structural stability of ternary aluminide formed. Different alloys were prepared, varying T in the row from Ti to Fe. Using electron microscopy and X-ray diffraction methods it was found that ThT{sub 2}Al{sub 20} phase adopts CeCr{sub 2}Al{sub 20} structure type when T = Ti, V, and Cr. Starting from Mn, the symmetry of the stable Al-rich phase, which forms in the alloys with the same composition, decreases from cubic to orthorhombic. The results of Density Functional Theory (DFT) calculations coincide with experiments. Concepts of the Theory of Coordination Compounds and Jahn–Teller effect were used to explain the observed abrupt change of the symmetry. These considerations were supported by DFT calculations. - Highlights: • Type of transition metal influences symmetry change in the ThT{sub 2}Al{sub 20} alloys. • It was found that cubic ThT{sub 2}Al{sub 20} phase is stable for T = Ti, V and Cr. • When T = Mn, Fe–Al + orthorhombic ThT{sub 2}Al{sub 10} are formed, lowering the symmetry. • Experimental results and DFT calculations were in full agreement. • TCC and of Jahn–Teller effect were used for explanation of the results.

EXO70C2 is a key regulatory factor for optimal tip growth of pollen

KAUST Repository

Synek, Lukas; Vukasinovic, Nemanja; Kulich, Ivan; Hala, Michal; Aldorfova, Klara; Fendrych, Matyas; Zarsky, Viktor

2017-01-01

paralogs. Out of 23 Arabidopsis EXO70 isoforms, we analyzed seven isoforms expressed in pollen. Genetic and microscopic analyses of single mutants in EXO70A2, C1, C2, F1, H3, H5, and H6 genes revealed that only a loss-of-function EXO70C2 allele resulted

Phase transition study in strongly correlated VO{sub 2} based sensing systems

Energy Technology Data Exchange (ETDEWEB)

Simo, A., E-mail: alinesimo.aline@gmail.com [UNESCO-UNISA Africa Chair in Nanoscience’s/Nanotechnology, College of Graduate Studies, University of South Africa, Muckleneuk ridge, P.O. Box 392, Pretoria (South Africa); Nanosciences African Network (NANOAFNET), iThemba LABS-National Research Foundation, 1 Old Faure road, Somerset West 7129, P.O. Box 722, Somerset West, Western Cape Province (South Africa); Kaviyarasu, K. [UNESCO-UNISA Africa Chair in Nanoscience’s/Nanotechnology, College of Graduate Studies, University of South Africa, Muckleneuk ridge, P.O. Box 392, Pretoria (South Africa); Nanosciences African Network (NANOAFNET), iThemba LABS-National Research Foundation, 1 Old Faure road, Somerset West 7129, P.O. Box 722, Somerset West, Western Cape Province (South Africa); Mwakikunga, B. [Council for Scientific and Industrial Research, P.O. Box 395, Pretoria 0001 (South Africa); Madjoe, R. [Physics Department, University of Western Cape, 7535 Belville Cape Town (South Africa); Gibaud, A. [Laboratoire de Physique de l’Etat Condensé, Université du Maine Faculte des sciences, UPRESA 6087, 72085, Le Mans Cedex 9 (France); Maaza, M. [UNESCO-UNISA Africa Chair in Nanoscience’s/Nanotechnology, College of Graduate Studies, University of South Africa, Muckleneuk ridge, P.O. Box 392, Pretoria (South Africa); Nanosciences African Network (NANOAFNET), iThemba LABS-National Research Foundation, 1 Old Faure road, Somerset West 7129, P.O. Box 722, Somerset West, Western Cape Province (South Africa)

2017-04-15

Highlights: • At 230 °C for about 48 h to prepare successfully VO{sub 2} nanobelts. • 1D shows good sensing performance due to the large active surface of the material. • The good selectivity of methanol compared to acetone and isopropanol. • VOC compounds was observed at room temperature. - Abstract: Intermediate phase monoclinic M2 was observed by inducing in situ X-ray thermo diffraction on VO{sub 2} (M) nanoplatelets. The solid-solid phase transition occurs at around 65 °C assisted with the percolative transition metal-insulator. The existence of an intermediate crystalline phase with room temperature insulator phase and high temperature metallic phase across MIT in VO{sub 2} could be of relevance to understand structural contributions to the phase transition dynamics. In addition, pellet of VO{sub 2} nanostructures have shown to present good sensing properties to various alcohols vapors at room temperature and good selectivity of methanol with 5.54% sensitivity and limit detection below 5 ppm, compared to isopropanol 3.2% and acetone 2.4% respectively.

Influence of lattice distortion on phase transition properties of polycrystalline VO{sub 2} thin film

Energy Technology Data Exchange (ETDEWEB)

Lin, Tiegui [State Key Laboratory of Advanced Welding and Joining, Harbin Institute of Technology, Harbin 150001 (China); Wang, Langping, E-mail: aplpwang@hit.edu.cn [State Key Laboratory of Advanced Welding and Joining, Harbin Institute of Technology, Harbin 150001 (China); Wang, Xiaofeng; Zhang, Yufen [State Key Laboratory of Advanced Welding and Joining, Harbin Institute of Technology, Harbin 150001 (China); Yu, Yonghao, E-mail: yhyu@hit.edu.cn [Academy of Fundamental and Interdisciplinary Science, Harbin Institute of Technology, Harbin 150001 (China)

2016-08-30

Highlights: • Polycrystalline VO{sub 2} thin films were fabricated by high power impulse magnetron sputtering. • The reported lowest phase transition temperature for undoped polycrystalline VO{sub 2} thin film was reduced to 32 °C by this research. • XRD patterns at varied temperatures revealed that the main structual change was a gradual shift in interplanar spacing with temperature. - Abstract: In this work, high power impulse magnetron sputtering was used to control the lattice distortion in polycrystalline VO{sub 2} thin film. SEM images revealed that all the VO{sub 2} thin films had crystallite sizes of below 20 nm, and similar configurations. UV–vis-near IR transmittance spectra measured at different temperatures showed that most of the as-deposited films had a typical metal–insulator transition. Four-point probe resistivity results showed that the transition temperature of the films varied from 54.5 to 32 °C. The X-ray diffraction (XRD) patterns of the as-deposited films revealed that most were polycrystalline monoclinic VO{sub 2}. The XRD results also confirmed that the lattice distortions in the as-deposited films were different, and the transition temperature decreased with the difference between the interplanar spacing of the as-deposited thin film and standard rutile VO{sub 2}. Furthermore, a room temperature rutile VO{sub 2} thin film was successfully synthesized when this difference was small enough. Additionally, XRD patterns measured at varied temperatures revealed that the phase transition process of the polycrystalline VO{sub 2} thin film was a coordinative deformation between grains with different orientations. The main structural change during the phase transition was a gradual shift in interplanar spacing with temperature.

Ferroelectric phase transition in hydrogen-bonded 2-aminopyridine phosphate (NC sub 4 H sub 4 NH sub 2)centre dot H sub 3 PO sub 4

CERN Document Server

Czapla, Z; Waskowska, A

2003-01-01

A new crystal of 2-aminopyridine phosphate (NC sub 4 H sub 4 NH sub 2)centre dot H sub 3 PO sub 4 has been grown and its x-ray structure and physical properties were studied. At room temperature the crystals are monoclinic, space group C2/c. The flat 2-aminopyridine cations are hydrogen bonded to the anionic [PO sub 4 ] groups. The interesting feature of the crystal structure is the three-dimensional network of hydrogen bonds including, among others, two strong, symmetrical O centre dot centre dot centre dot H, H centre dot centre dot centre dot O interactions with disordered proton locations. Symmetrically related PO sub 4 anions linked through these protons form infinite (PO sub 4) subinfinity chains along the crystal a-axis. The anomalies in the temperature dependence of the electric permittivity showed that the crystal undergoes ferroelectric phase transition at T sub c = 103.5 K. The spontaneous polarization takes place along the crystal a-axis, being parallel to the chains of the hydrogen-bonded PO sub ...

The Role of the Exo-Xis Region in Oxidative Stress-Mediated Induction of Shiga Toxin-Converting Prophages

Directory of Open Access Journals (Sweden)

Katarzyna Licznerska

2016-01-01

Full Text Available Previous studies indicated that these genetic elements could be involved in the regulation of lysogenization and prophage induction processes. The effects were dramatic in Shiga toxin-converting phage Φ24B after treatment with oxidative stress-inducing agent, hydrogen peroxide, while they were less pronounced in bacteriophage λ and in both phages irradiated with UV. The hydrogen peroxide-caused prophage induction was found to be RecA-dependent. Importantly, in hydrogen peroxide-treated E. coli cells lysogenic for either λ or Φ24B, deletion of the exo-xis region resulted in a significant decrease in the levels of expression of the S.O.S. regulon genes. Moreover, under these conditions, a dramatic decrease in the levels of expression of phage genes crucial for lytic development (particularly xis, exo, N, cro, O, Q, and R could be observed in Φ24B-, but not in λ-bearing cells. We conclude that genes located in the exo-xis region are necessary for efficient expression of both host S.O.S regulon in lysogenic bacteria and regulatory genes of Shiga toxin-converting bacteriophage Φ24B.

Inter- and intraplane softening of the vortex structure in Bi sub 2. 1 Sr sub 1. 9 Ca sub 0. 9 Cu sub 2 O sub 8+. delta. : a two-step transition. [Bi-Sr-Ca-Cu-O

Energy Technology Data Exchange (ETDEWEB)

Yazyi, J; Arribere, A; Duran, C; Cruz, F de la [Centro Atomico Bariloche and Inst. Balseiro, Rio Negro (Argentina); Mitzi, D B; Kapitulnik, A [Stanford Univ., CA (United States)

1991-12-15

High Q mechanical oscillator and AC susceptibility techniques have been used to study vortex dynamics in high quality single crystals of Bi{sub 2.1}Sr{sub 1.9}Ca{sub 0.9}Cu{sub 2}O{sub 8+{delta}} over a wide range of magnetic fields and different relative orientations between the magnetic field and the crystalline c-axis. Our results confirm the existence of two transitions in the vortex response. We show that the transition at lower temperatures is associated to currents flowing across the Cu-O planes and the other one to currents in the planes. This means that the reversible region of the phase diagram is reached in two steps when increasing temperature. (orig.).

Developing magnetofunctionality: Coupled structural and magnetic phase transition in AlFe{sub 2}B{sub 2}

Energy Technology Data Exchange (ETDEWEB)

Lewis, L.H., E-mail: lhlewis@neu.edu [Department of Chemical Engineering, Northeastern University, Boston, MA 02115 (United States); Department of Mechanical and Industrial Engineering, Northeastern University, Boston, MA 02115 (United States); George J. Kostas Research Institute for Homeland Security, Northeastern University, Burlington, MA (United States); Barua, R., E-mail: radhika.barua@gmail.com [Department of Chemical Engineering, Northeastern University, Boston, MA 02115 (United States); Department of Mechanical and Industrial Engineering, Northeastern University, Boston, MA 02115 (United States); George J. Kostas Research Institute for Homeland Security, Northeastern University, Burlington, MA (United States); Lejeune, B. [Department of Chemical Engineering, Northeastern University, Boston, MA 02115 (United States); George J. Kostas Research Institute for Homeland Security, Northeastern University, Burlington, MA (United States)

2015-11-25

Understanding correlations between crystal structure and magnetism is key to tuning the response of magnetic materials systems that exhibit large functional effects in response to small excursions in magnetic field or strain. To this end, temperature-dependent structure-magnetic property correlations are reported in samples of AlFe{sub 2}B{sub 2} with the orthorhombic AlMn{sub 2}B{sub 2}-type layered structure as it traverses a thermally-hysteretic first-order magnetic phase change at a transition temperature of T{sub t} = 280 K. Temperature-dependent x-ray diffraction carried out in the temperature range 200 K ≤ T ≤ 298 K reveals that the a and b lattice parameters increase by 0.2% and 0.1% respectively upon heating, while the c lattice parameter decreases by 0.3%, providing a conserved unit cell volume through T{sub t}. A very small volumetric thermal expansion coefficient 4.4 × 10{sup −6}/K is determined in this temperature range that is one order of magnitude smaller than that of aluminum and only slightly larger than that of Invar. The latent heat of transformation associated with this magnetostructural phase transformation is determined as 4.4 J/g, similar to that of other magnetostructural materials. Overall, these features confirm a first-order thermodynamic phase change in the AlFe{sub 2}B{sub 2} system that emphasizes strong coupling between the magnetic spins and the lattice to support potential magnetofunctional applications for energy transformation and harvesting. - Highlights: • AlFe{sub 2}B{sub 2} undergoes a first-order magnetostructural transformation near room temperature. • The AlFe{sub 2}B{sub 2} Curie transition is thermally hysteretic and magnetic field dependent. • XRD reveals a volume-conserved change in the lattice constants of the AlFe{sub 2}B{sub 2} unit cell. • The latent heat of the magnetostructural transformation is determined as 4.4 J/g. • Results emphasize strong coupling between the magnetic spins and the lattice

Phase transition in Li{sub 1/2}Bi{sub 1/2}TiO{sub 3}

Energy Technology Data Exchange (ETDEWEB)

Barik, Subrat K; Choudhary, R N.P. [Dept. of Physics and Meteorology, Indian Institute of Technology Kharagpur, Kharagpur (India); Mahapatra, P K [Dept. of Physics and Technophysics, Vidyasagar Univ., Midnapur (India)

2008-07-01

Full text: Recent advancements in the electronics in this miniaturization age are found in many ferroelectric based materials of different structural families. Among them, perovskites are being used for the possible forefront applications in the areas of research as well as in industrial applications. Though a lot of lead-based compounds like PZT, PMN etc. have been investigated for device applications, the manufacturing companies are now heading towards the environmental friendly lead-free compounds. Li{sub 1/2}Bi{sub 1/2}TiO{sub 3} comes under this group. Here we report the studies of phase transition of Li{sub 1/2}Bi{sub 1/2}TiO{sub 3} (LBT) ceramic which was prepared by a mixed-oxide technique. The formation of the compound was confirmed by XRD studies. The dielectric permittivity, the loss tangent and polarization of the sample were studied in a wide frequency and temperature range. Detailed analysis of impedance spectrum obtained at different temperatures and frequencies suggested that the electrical properties of the material are strongly temperature dependant. The Nequist plots clearly showed the presence of both bulk and grain boundary effect in the compound. The frequency dependent ac conductivity at different temperatures indicated the conduction process is thermally activated. The activation energy was calculated from the temperature variation of d.c. conductivity.

Method for preparing high transition temperature Nb.sub.3 Ge superconductors

Science.gov (United States)

Newkirk, Lawrence R.; Valencia, Flavio A.

1977-01-01

Bulk coatings of Nb.sub.3 Ge superconductors having transition temperatures in excess of 20 K are readily formed by a chemical vapor deposition technique involving the coreduction of NbCl.sub.5 and GeCl.sub.4 in the presence of hydrogen. The NbCl.sub.5 vapor may advantageously be formed quantitatively in the temperature range of about 250.degree. to 260.degree. C by the chlorination of Nb metal provided the partial pressure of the product NbCl.sub.5 vapor is maintained at or below about 0.1 atm.

Investigation of the magnetic phase transition in thin Fe{sub 50}Pt{sub 50-x}Rh{sub x} films by neutron diffraction

Energy Technology Data Exchange (ETDEWEB)

Fenske, Jochen; Lott, Dieter; Schreyer, Andreas [GKSS Research Centre, Geesthacht (Germany); Mankey, Gary J. [MINT Center, The University of Alabama, Tuscaloosa, AL (United States); Schmidt, Wolfgang; Schmalzl, Karin [JCNS, Juelich (Germany)

2008-07-01

In the last years perpendicular recording plays a major role in the development of novel magnetic data storage. Here, materials with high anisotropy are used which delivers good thermal stability. However in order to write the bits a high magnetic field is necessary. By the use of soft underlayers the write field can be significant reduced. Fe{sub 50}Pt{sub 50-x}Rh{sub x} is a promising candidate for such an underlayer. Magnetization measurements of the bulk samples for x=10 refer to a antiferromagnetic (AF)/ferromagnetic (FM) phase transition at about 150 K when heated. Additional magnetostriction measurements indicate that the phase transition could also be induced by applying a magnetic field. The FM state lowers the high anisotropy and therefore the high write field. The AF state helps to stabilize the recording media via exchange interaction. For technical applications the use of thin films are essential to save space and costs for the next generation of magnetic storage devices. Here we present results on several thin Fe{sub 50}Pt{sub 50-x}Rh{sub x} films with different concentration of Rh. The films were examined by polarized and unpolarized neutron diffraction in dependence of temperature and magnetic field.

Critical behavior of the ferromagnetic-paramagnetic phase transition in Fe{sub 90−x}Ni{sub x}Zr{sub 10} alloy ribbons

Energy Technology Data Exchange (ETDEWEB)

Thanh, Tran Dang, E-mail: thanhxraylab@yahoo.com [Department of Physics, Chungbuk National University, Cheongju 361-763 (Korea, Republic of); Institute of Materials Science, VAST, 18 Hoang Quoc Viet, Hanoi (Viet Nam); Huy Dan, Nguyen [Institute of Materials Science, VAST, 18 Hoang Quoc Viet, Hanoi (Viet Nam); Phan, The-Long; Yu, Seong-Cho, E-mail: scyu@chungbuk.ac.kr [Department of Physics, Chungbuk National University, Cheongju 361-763 (Korea, Republic of); Kumarakuru, Haridas; Olivier, Ezra J.; Neethling, Johannes H. [Centre for HRTEM, Department of Physics, Nelson Mandela Metropolitan University, Port Elizabeth 6031 (South Africa)

2014-01-14

This work presents a detailed study on the critical behavior of the ferromagnetic-paramagnetic (FM-PM) phase transition in Fe{sub 90−x}Ni{sub x}Zr{sub 10} (x = 0 and 5) alloy ribbons. Basing on field dependences of magnetization (M-H), M{sup 2} versus H/M plots prove the alloys exhibiting a second-order magnetic phase transition. To investigate the nature of the FM-PM phase transition at T{sub C} = 245 and 306 K for x = 0 and 5, respectively, we performed a critical-exponent study. The values of critical components β, γ, and δ determined by using the modified Arrott plots, Kouvel-Fisher (KF), and critical isotherm analyses agree with each other. For x = 0, the critical parameters β = 0.365 ± 0.013 and γ = 1.615 ± 0.033 are obtained by modified Arrott plots while β = 0.368 ± 0.008 and γ = 1.612 ± 0.016 are obtained by the KF method. These values are close to those expected for the 3D-Heisenberg model, revealing short-range FM interactions in Fe{sub 90}Zr{sub 10}. Meanwhile, for x = 5, the values of the critical parameters β = 0.423 ± 0.008 and γ = 1.325 ± 0.036 are obtained by modified Arrott plots, and β = 0.425 ± 0.006 and γ = 1.323 ± 0.012 are obtained by the KF method. The falling of the β value in between the values of the mean-field theory (β = 0.5) and the 3D-Heisenberg model (β = 0.365) indicates an existence of FM short-range order and magnetic inhomogeneity in Fe{sub 85}Ni{sub 5}Zr{sub 10}. With a partial replacement of Ni for Fe in Fe{sub 90−x}Ni{sub x}Zr{sub 10}, the value of the critical exponent β trends to shift towards that of the mean-field theory. Such the result proves the presence of Ni favors establishing FM long-range order. The nature of this phenomenon is carefully discussed.

THE KEPLER-19 SYSTEM: A TRANSITING 2.2 R{sub Circled-Plus} PLANET AND A SECOND PLANET DETECTED VIA TRANSIT TIMING VARIATIONS

Energy Technology Data Exchange (ETDEWEB)

Ballard, Sarah; Fressin, Francois; Charbonneau, David; Desert, Jean-Michel; Torres, Guillermo; Holman, Matthew J. [Harvard-Smithsonian Center for Astrophysics, 60 Garden Street, Cambridge, MA 02138 (United States); Fabrycky, Daniel [Department of Astronomy and Astrophysics, University of California Santa Cruz, Santa Cruz, CA 95064 (United States); Marcy, Geoffrey; Isaacson, Howard [Department of Astronomy, University of California Berkeley, Berkeley, CA 94720 (United States); Burke, Christopher J.; Henze, Christopher; Howell, Steven B.; Bryson, Stephen T.; Rowe, Jason F.; Lissauer, Jack J. [NASA Ames Research Center, Moffett Field, CA 94035 (United States); Steffen, Jason H. [Fermilab Center for Particle Astrophysics, P.O. Box 500, Batavia, IL 60510 (United States); Ciardi, David R. [NASA Exoplanet Science Institute/Caltech, Pasadena, CA 91125 (United States); Cochran, William D.; Endl, Michael [McDonald Observatory, The University of Texas, Austin, TX 78712 (United States); Jenkins, Jon M., E-mail: sballard@cfa.harvard.edu [SETI Institute/NASA Ames Research Center, Moffett Field, CA 94035 (United States); and others

2011-12-20

We present the discovery of the Kepler-19 planetary system, which we first identified from a 9.3 day periodic transit signal in the Kepler photometry. From high-resolution spectroscopy of the star, we find a stellar effective temperature T{sub eff} = 5541 {+-} 60 K, a metallicity [Fe/H] = -0.13 {+-} 0.06, and a surface gravity log(g) = 4.59 {+-} 0.10. We combine the estimate of T{sub eff} and [Fe/H] with an estimate of the stellar density derived from the photometric light curve to deduce a stellar mass of M{sub *} = 0.936 {+-} 0.040 M{sub Sun} and a stellar radius of R{sub *} = 0.850 {+-} 0.018 R{sub Sun} (these errors do not include uncertainties in the stellar models). We rule out the possibility that the transits result from an astrophysical false positive by first identifying the subset of stellar blends that reproduce the precise shape of the light curve. Using the additional constraints from the measured color of the system, the absence of a secondary source in the high-resolution spectrum, and the absence of a secondary source in the adaptive optics imaging, we conclude that the planetary scenario is more than three orders of magnitude more likely than a blend. The blend scenario is independently disfavored by the achromaticity of the transit: we measure a transit depth with Spitzer at 4.5 {mu}m of 547{sup +113}{sub -110} ppm, consistent with the depth measured in the Kepler optical bandpass of 567 {+-} 6 ppm (corrected for stellar limb darkening). We determine a physical radius of the planet Kepler-19b of R{sub p} = 2.209 {+-} 0.048 R{sub Circled-Plus }; the uncertainty is dominated by uncertainty in the stellar parameters. From radial velocity observations of the star, we find an upper limit on the planet mass of 20.3 M{sub Circled-Plus }, corresponding to a maximum density of 10.4 g cm{sup -3}. We report a significant sinusoidal deviation of the transit times from a predicted linear ephemeris, which we conclude is due to an additional perturbing body in

Exploration of R<sub>2sub>XM>2sub> (R=Sc, Y, Ti, Zr, Hf, rare earth; X=main group element; M=transition metal, Si, Ge): Structural Motifs, the novel Compound Gd<sub>2sub>AlGe>2sub> and Analysis of the U<sub>3sub>Si>2sub> and Zr<sub>3sub>Al>2 sub>Structure Types

Energy Technology Data Exchange (ETDEWEB)

McWhorter, Sean William [Iowa State Univ., Ames, IA (United States)

2006-01-01

In the process of exploring and understanding the influence of crystal structure on the system of compounds with the composition Gd<sub>5sub>(Si_xGe>1-xsub>)>4sub> several new compounds were synthesized with different crystal structures, but similar structural features. In Gd<sub>5sub>(Si_xGe>1-xsub>)>4sub>, the main feature of interest is the magnetocaloric effect (MCE), which allows the material to be useful in magnetic refrigeration applications. The MCE is based on the magnetic interactions of the Gd atoms in the crystal structure, which varies with x (the amount of Si in the compound). The crystal structure of Gd<sub>5sub>(Si_xGe>1-xsub>)>4sub> can be thought of as being formed from two 3²434 nets of Gd atoms, with additional Gd atoms in the cubic voids and Si/Ge atoms in the trigonal prismatic voids. Attempts were made to substitute nonmagnetic atoms for magnetic Gd using In, Mg and Al. Gd<sub>2sub>MgGe>2sub> and Gd<sub>2sub>InGe>2sub> both possess the same 3²434 nets of Gd atoms as Gd<sub>5sub>(Si_xGe>1-xsub>)>4sub>, but these nets are connected differently, forming the Mo<sub>2sub>FeB>2sub> crystal structure. A search of the literature revealed that compounds with the composition R<sub>2sub>XM>2sub> (R=Sc, Y, Ti, Zr, Hf, rare earth; X=main group element; M=transition metal, Si, Ge) crystallize in one of four crystal structures: the Mo<sub>2sub>FeB>2sub>, Zr<sub>3sub>Al>2sub>, Mn<sub>2sub>AlB>2sub> and W<sub>2sub>CoB>2sub> crystal structures. These crystal structures are described, and the relationships between them are highlighted. Gd<sub>2sub>AlGe>2sub> forms an entirely new crystal structure, and the details of its synthesis and characterization are given. Electronic structure calculations are performed to understand the nature of bonding in this compound and how

A high-temperature Raman scattering study of the phase transitions in GaPO{sub 4} and in the AlPO{sub 4}-GaPO{sub 4} system

Energy Technology Data Exchange (ETDEWEB)

Angot, E [Laboratoire des Colloides, des Verres et des Nanomateriaux, UMR CNRS 5587, Universite Montpellier II, cc026, Place E Bataillon, F-34095 Montpellier Cedex 5 (France); Parc, R Le [Laboratoire des Colloides, des Verres et des Nanomateriaux, UMR CNRS 5587, Universite Montpellier II, cc026, Place E Bataillon, F-34095 Montpellier Cedex 5 (France); Levelut, C [Laboratoire des Colloides, des Verres et des Nanomateriaux, UMR CNRS 5587, Universite Montpellier II, cc026, Place E Bataillon, F-34095 Montpellier Cedex 5 (France); Beaurain, M [Laboratoire de Physicochimie de la Matiere Condensee, UMR CNRS 5617, Universite Montpellier II, cc003, Place E Bataillon, F-34095 Montpellier Cedex 5 (France); Armand, P [Laboratoire de Physicochimie de la Matiere Condensee, UMR CNRS 5617, Universite Montpellier II, cc003, Place E Bataillon, F-34095 Montpellier Cedex 5 (France); Cambon, O [Laboratoire de Physicochimie de la Matiere Condensee, UMR CNRS 5617, Universite Montpellier II, cc003, Place E Bataillon, F-34095 Montpellier Cedex 5 (France); Haines, J [Laboratoire de Physicochimie de la Matiere Condensee, UMR CNRS 5617, Universite Montpellier II, cc003, Place E Bataillon, F-34095 Montpellier Cedex 5 (France)

2006-05-03

Al{sub 1-x}Ga{sub x}PO{sub 4} solid solutions (x = 0.2, 0.3, 0.38, 0.7) and the pure AlPO{sub 4} (x = 0) and GaPO{sub 4} (x = 1) end members with the {alpha}-quartz-type structure were studied by Raman scattering. An investigation as a function of composition enabled the various modes to be assigned, in particular coupled and decoupled vibrations. The tetrahedral tilting modes, which have been linked to high-temperature phase transitions to {beta}-quartz-type forms, were found to be decoupled. In addition, it is shown that Raman spectroscopy is a powerful technique for determining the gallium content of these solid solutions. Single crystals with x = 0.2, 0.38, and 1.0 (GaPO{sub 4}) were investigated at high temperature. The composition Al{sub 0.8}Ga{sub 0.2}PO{sub 4} was found to exhibit sequential transitions upon heating to the {beta}-quartz and {beta}-cristobalite forms at close to 993 K and 1073 K, respectively. Direct {alpha}-quartz-{beta}-cristobalite transitions were observed for the two other compositions at close to 1083 K and 1253 K, respectively, upon heating. The spectra of the {beta}-quartz and {beta}-cristobalite forms indicate the presence of significant disorder. Back transformation to the {alpha}-quartz-type form occurred readily with a hysteresis of less than 100 K for the composition x = 0.38 and for pure GaPO{sub 4}. Rapid cooling was necessary to obtain the metastable {alpha}-cristobalite form. In contrast, for Al{sub 0.80}Ga{sub 0.20}PO{sub 4}, the {alpha}-cristobalite form was obtained even upon slow cooling.

Critical parameters near the ferromagnetic-paramagnetic phase transition in La{sub 0.7}A{sub 0.3}(Mn{sub 1-x}b{sub x})O{sub 3} (A=Sr; B=Ti and Al; x=0.0 and 0.05) compounds

Energy Technology Data Exchange (ETDEWEB)

Khiem, N.V. [Hongduc University, 307 Lelai Street, Thanhhoa City (Viet Nam)], E-mail: nvkhiem2002@yahoo.com; Phong, P.T. [Institute of Materials Science, Vietnamese Academy of Science and Technology, 18 Hoang Quoc Viet Road, Cau Giay District, Hanoi (Viet Nam); Bau, L.V. [Hongduc University, 307 Lelai Street, Thanhhoa City (Viet Nam); Nam, D.N.H.; Hong, L.V.; Phuc, N.X. [Institute of Materials Science, Vietnamese Academy of Science and Technology, 18 Hoang Quoc Viet Road, Cau Giay District, Hanoi (Viet Nam)

2009-07-15

The critical parameters provide important information concerning the interaction mechanisms near the paramagnetic-to-ferromagnetic transition. In this paper, we present a thorough study for the critical behavior of La{sub 0.7}A{sub 0.3}(Mn{sub 1-x}B{sub x})O{sub 3} (A=Sr; B=Ti and Al; x=0.0 and 0.05) polycrystalline samples near ferromagnetic-paramagnetic phase transition temperature by analyzing isothermal magnetization data. We have analyzed our dc-magnetization data near the transition temperature with the help of the modified Arrot plot, Kouvel-Fisher method. We have determined the critical temperature T{sub C} and the critical parameters {beta}, {gamma} and {delta}. With the values of T{sub C}, {beta} and {gamma}, we plot Mx(1-T/T{sub C}){sup -{beta}} vs. Hx(1-T/T{sub C}){sup -{gamma}}. All the data collapse on one of the two curves. This suggests that the data below and above T{sub C} obey scaling, following a single equation of state. Critical parameters for x=0 and x{sub Ti}=0.05 samples are between those predicted for a 3D-Heisenberg model and mean-field theory and for x{sub Al}=0.05 samples the values obtained for the critical parameters are close to those predicted by the mean-field theory.

Tuning the band gap of PbCrO{sub 4} through high-pressure: Evidence of wide-to-narrow semiconductor transitions

Energy Technology Data Exchange (ETDEWEB)

Errandonea, D., E-mail: daniel.errandonea@uv.es [Departamento de Física Aplicada-ICMUV, Universitat de València, MALTA ConsoliderTeam, C/Dr. Moliner 50, 46100 Burjassot (Spain); Bandiello, E.; Segura, A. [Departamento de Física Aplicada-ICMUV, Universitat de València, MALTA ConsoliderTeam, C/Dr. Moliner 50, 46100 Burjassot (Spain); Hamlin, J.J.; Maple, M.B. [Department of Physics, University of California, San Diego, La Jolla, CA 92093 (United States); Rodriguez-Hernandez, P.; Muñoz, A. [Departamento de Física Fundamental II, Instituto de Materiales y Nanotecnología, Universidad de La Laguna, MALTA ConsoliderTeam, La Laguna, 38205 Tenerife (Spain)

2014-02-25

Highlights: • Electronic and optical properties of PbCrO{sub 4} are studied under compression. • Band-gap collapses are observed and correlated with structural phase transitions. • PbCrO{sub 4} band-gap is reduced from 2.3 to 0.8 eV in a 20 GPa range. • PbCrO{sub 4} is an n-type semiconductor with donor levels associated to Frenkel defects. • A deep-to-shallow donor transformation at HP induces a large resistivity decrease. -- Abstract: The electronic transport properties and optical properties of lead(II) chromate (PbCrO{sub 4}) have been studied at high pressure by means of resistivity, Hall-effect, and optical-absorption measurements. Band-structure first-principle calculations have been also performed. We found that the low-pressure phase is a direct band-gap semiconductor (Eg = 2.3 eV) that shows a high resistivity. At 3.5 GPa, associated to a structural phase transition, a band-gap collapse takes place, becoming Eg = 1.8 eV. At the same pressure the resistivity suddenly decreases due to an increase of the carrier concentration. In the HP phase, PbCrO{sub 4} behaves as an n-type semiconductor, with a donor level probably associated to the formation of oxygen vacancies. At 15 GPa a second phase transition occurs to a phase with Eg = 1.2 eV. In this phase, the resistivity increases as pressure does probably due to the self-compensation of donor levels and the augmentation of the scattering of electrons with ionized impurities. In the three phases the band gap red shifts under compression. At 20 GPa, Eg reaches a value of 0.8 eV, behaving PbCrO{sub 4} as a narrow-gap semiconductor.

Multichannel interactions in the (1σ/sub g/)2(1σ/sub u/)nsσ, ndλ(3Σ+/sub u/,3Σ+/sub u/,3Pi/sub u/,3Δ/sub u/) Rydberg structures of He2

International Nuclear Information System (INIS)

Ginter, D.S.; Ginter, M.L.

1988-01-01

We show that a minimal parameter coupled channel model based on eigenquantum defect theory can reproduce quantitatively the known Rydberg structures associated with six channels of nsσ,ndλ( 3 Σ + /sub u/, 3 Σ + /sub u/, 3 Pi/sub u/, 3 Δ/sub u/) v = 0 ancestry in He 2 . Except for a few levels affected by accidental perturbations, these extensive level structures can be reproduced to within average experimental uncertainties. Previously unreported spectral analyses for transitions to the b 3 Pi/sub g/ state from rotational levels in the nl channel segments with n = 12--18 are included in this work. These spectral transitions were predicted and observed in the early stages of this investigation and were used to determine a number of new energy levels for the n = 3--18 data base used in subsequent calculations. The model uses a U matrix modified slightly from a Hund's case (b) to case (d) transformation and energy dependent eigenquantum defects μ/sub α/. Discussed in detail is a specific 14 parameter representation for ∼500 energy levels in which 2 parameters modify U to include interactions between ns and nd and 12 parameters describe the variation of the μ/sub α/'s with energy

Dependence of vortex phase transitions in mesoscopic Bi{sub 2}Sr{sub 2}CaCuO{sub 8} superconductor at tilted magnetic fields

Energy Technology Data Exchange (ETDEWEB)

Dolz, M I; Pastoriza, H, E-mail: mdolz@cab.cnea.gov.a, E-mail: hernan@cab.cnea.gov.a [Centro Atomico Bariloche, Comision Nacional de Energa Atomica and CONICET, R8402AGP S. C. de Bariloche (Argentina)

2009-03-01

A micron sized single crystal of the superconductor Bi{sub 2}Sr{sub 2}CaCuO{sub 8} was studied using silicon mechanical micro-oscillators at various tilt angles of the dc magnetic field with respect to the c axis of the sample. Different phases of the vortex matter were detected by measuring changes in the value and sign of the oscillator resonant frequency variation with temperature. We could explain the change in the sign of this variation at high temperatures as the transition from the 2D liquid of decoupled pancakes to a reversible 3D vortex lattice. The data indicates that this transition only depends on the magnetic field perpendicular to the superconducting layers while the dissipation involved in this process depends on the component parallel to them.

Adsorption of F{sub 2}C=CFCl on TiO{sub 2} nano-powder: Structures, energetics and vibrational properties from DRIFT spectroscopy and periodic quantum chemical calculations

Energy Technology Data Exchange (ETDEWEB)

Tasinato, Nicola, E-mail: tasinato@unive.it; Moro, Daniele; Stoppa, Paolo; Pietropolli Charmet, Andrea; Toninello, Piero; Giorgianni, Santi

2015-10-30

Graphical abstract: - Highlights: • Adsorption of F{sub 2}C=CFCl on TiO{sub 2} unveiled by DRIFTS and periodic DFT. • Structural, energetic and vibrational properties of F{sub 2}C=CFCl @ anatase (1 0 1). • Binding energies (B3LYP-D2) between −17 and −46 kJ mol{sup −1} depending on the anchor point. • Theory and experiment converge on the CF{sub 2} moiety as the main anchor point. - Abstract: Photodegradation over titanium dioxide (TiO{sub 2}) is a very appealing technology for removing environmental pollutants from the air, the adsorption interaction being the first step of the whole reaction pathway. In the present work the adsorption of F{sub 2}C=CFCl (chlorotrifluoroethene, halon 1113), a compound used by industry and detected in the atmosphere, on a commercial TiO{sub 2} nano-powder is investigated experimentally by in situ DRIFT spectroscopy and theoretically through periodic ab initio calculations rooted in DFT. The spectra of the adsorbed molecule suggest that the anchoring to the surface mainly takes place through F atoms. Theoretically, five adsorption configurations for the molecule interacting with the anatase (1 0 1) surface are simulated at B3LYP level and for each of them, structures, binding energies and vibrational frequencies are derived. The interplay between theory and experiments shows the coexistence of different adsorption configurations, the foremost ones featuring the interaction of one F atom with a fivefold coordinated Ti{sup 4+} of the surface. These two adsorption models, which mostly differ for the orientation of the adsorbate with respect to the surface, feature a binding energy of −45.6 and −41.0 kJ mol{sup −1} according to dispersion corrected DFT calculations. The favorable adsorption interaction appears as an important requirement toward the application of titanium dioxide technologies for the photocatalytic degradation of halon 1113.

Simultaneous amyloglucosidase and exo-polygalacturonase production by Aspergillus niger using solid-state fermentation

Directory of Open Access Journals (Sweden)

Jorge Alberto Vieira Costa

2007-09-01

Full Text Available Amyloglucosidase (AMG and exo-polygalacturonase (exo-PG were simultaneously produced by two different strains of Aspergillus niger in solid-state fermentation (SSF using defatted rice-bran as substrate. The effect of Aspergillus niger strain (t0005/007-2 and/or CCT 3312, inoculum type (spore suspension or fermented bran and addition of inducers (pectin and/or starch to the culture media was studied using a 3² x 2¹ factorial experimental design. The production of AMG and exo-PG was significantly affected by fungal strain and inoculum type but inducers had no effect. The maximum yields obtained were 1310 U/g dm for AMG using a spore suspension of A. niger CCT 3312 and 50.2 U/g dm for exo-PG production, using A. niger t0005/007-2 and fermented bran as inoculum. The yields obtained represented acceptable values in comparison with data available in the literature and indicated that defatted rice-bran was a good nutrient source.As enzimas amiloglicosidase (AMG e exo-poligalacturonase (exo-PG foram produzidas simultaneamente por duas cepas de Aspergillus niger, através de fermentação em estado sólido usando farelo de arroz desengordurado como substrato. Foram avaliados os efeitos da cepa de Aspergillus niger, tipo de inóculo e adição de indutores no meio de cultura, utilizando-se um planejamento experimental fracionário 3² x 2¹. O máximo rendimento obtido foi 1310 U/g ms para a produção de AMG e 50,2 U/g ms para a exo-PG. Comparando-se estes resultados com dados da literatura pode-se dizer que os rendimentos obtidos foram aceitáveis e indicam que o farelo de arroz desengordurado é uma boa fonte de nutrientes. A produção de AMG e exo-PG foi significativamente afetada pelas variáveis cepa de A. niger e tipo de inóculo, enquanto a variável indutor não apresentou influência significativa na produção destas enzimas.

Dynamics of the magneto structural phase transition in La(Fe{sub 0.9}Co{sub 0.015}Si{sub 0.085}){sub 13} observed by magneto-optical imaging

Energy Technology Data Exchange (ETDEWEB)

Kuepferling, M., E-mail: m.kuepferling@inrim.it; Basso, V. [Istituto Nazionale di Ricerca Metrologica (INRIM), Strada delle Cacce 91, 10135 Turin (Italy); Bennati, C. [Istituto Nazionale di Ricerca Metrologica (INRIM), Strada delle Cacce 91, 10135 Turin (Italy); Department of Applied Science and Technology, Politecnico di Torino, C.so Duca degli Abruzzi 24, 10129 Turin (Italy); Laviano, F.; Ghigo, G. [Department of Applied Science and Technology, Politecnico di Torino, C.so Duca degli Abruzzi 24, 10129 Turin (Italy)

2014-05-07

We investigate the temperature induced ferromagnetic to paramagnetic phase transition in Co substituted La(Fe{sub x}Co{sub y}Si{sub 1−x−y}){sub 13} with x = 0.9 and low Co content of y = 0.015 (T{sub c}≃200 K) by means of magneto-optical imaging with indicator film and by calorimetry at very low temperature rates. We were able to visualize the motion of the ferromagnetic (FM)/paramagnetic (PM) front which is forming reproducible patterns independently of the temperature rate. The average velocity of the FM/PM front was calculated to be 10{sup −4} m/s during the continuous propagation and 4×10{sup −3} m/s during an avalanche. The heat flux was measured at low temperature rates by a differential scanning calorimeter and shows a reproducible sequence of individual and separated avalanches which occurs independently of the rate. We interpret the observed effects as the result of the athermal character of the phase transition.

Live from the Moon ExoLab: EuroMoonMars Simulation at ESTEC 2017

Science.gov (United States)

Neklesa, A.; Foing, B. H.; Lillo, A.; Evellin, P.; Kołodziejczyk, A.; Jonglez, C.; Heinicke, C.; Harasymczuk, M.; Authier, L.; Blanc, A.; Chahla, C.; Tomic, A.; Mirino, M.; Schlacht, I.; Hettrich, S.; Pacher, T.

2017-10-01

Space enthusiasts simulated the landing on the Moon having pre-landed Habitat ExoHab, ExoLab 2.0, supported by the control centre on Earth. We give here the first-hand experience from a reporter (A.N.) who joined the space crew.

Absolute Transition Rates in {sup 188}lr

Energy Technology Data Exchange (ETDEWEB)

Malmskog, S G; Berg, V

1969-09-15

Half-lives of several excited levels in {sup 188}lr have been measured using an electron-electron delayed coincidence spectrometer. Active {sup 188}Pt sources were prepared from spallation products using the ISOLDE on-line mass separator facility at CERN. The following half-lives were obtained: T{sub 1/2} (54.8 keV level) = (1.93 {+-} 0.10) nsec; T{sub 1/2} (96.7 keV level) = (0.59 {+-} 0.12) nsec; T{sub 1/2} (187.6 keV level) = (0.056 {+-} 0.013) nsec; T{sub 1/2} (195.1 keV level) = (0.051 {+-} 0.010) nsec; T{sub 1/2} (478. 3 keV level) {<=} 0.15 nsec The 54.8 keV transition was found to have an enhanced E2 transition probability indicating a collective character for this transition.

Phase transitions in complex oxide systems based on Al{sub 2}O{sub 3} and ZrO{sub 2}; Przemiany fazowe w zlozonych ukladach tlenkowych na bazie Al{sub 2}O{sub 3} i ZrO{sub 2} zachodzace w procesach z szybkozmiennym dzialaniem temperatury

Energy Technology Data Exchange (ETDEWEB)

Gorski, L [Institute of Atomic Energy, Otwock-Swierk (Poland)

1999-07-01

Different compositions of materials based on Al{sub 2}O{sub 3} and ZrO{sub 2} and protective coatings sprayed from them working in the high temperature region are studied. There are especially thermal barrier coatings of increasing resistance to thermal shocks and conditions of corrosion and erosion caused by the hot gases and liquids. Such conditions are encountered in many technical branches among others in jet and Diesel engines. These coatings are deposited by the plasma spraying process and their resistance to thermal shocks is studied on special experimental arrangement in the conditions near to coatings applications. Both above processes are characterized by a short time temperature action with subsequent high cooling rate, which may cause phase transitions other than in the conditions of thermodynamical equilibrium. These transitions are studied by X-ray diffraction analysis methods. The microstructure changes accompanied to phase transitions are determined by light microscopy and scanning electron microscopy methods. The cases of coating degradation caused by thermal shocks have been observed. The highest resistance to thermal fatigue conditions (up to thermal shocks) show coatings based on Al{sub 2}O{sub 3} containing aluminium titanate and coatings based on ZrO{sub 2} stabilised by 7-8% of Y{sub 2}O{sub 3}. (author)

Wet-etching induced abnormal phase transition in highly strained VO{sub 2}/TiO{sub 2} (001) epitaxial film

Energy Technology Data Exchange (ETDEWEB)

Ren, Hui; Chen, Shi; Chen, Yuliang; Luo, Zhenlin; Zhou, Jingtian; Zheng, Xusheng; Wang, Liangxin; Li, Bowen; Zou, Chongwen [National Synchrotron Radiation Laboratory, University of Science and Technology of China, Hefei (China)

2018-01-15

The metal-insulator transition (MIT) behavior in vanadium dioxide (VO{sub 2}) epitaxial film is known to be dramatically affected by interfacial stress due to lattice mismatching. For the VO{sub 2}/TiO{sub 2} (001) system, there exists a considerable strain in ultra-thin VO{sub 2} thin film, which shows a lower T{sub c} value close to room temperature. As the VO{sub 2} epitaxial film grows thicker layer-by-layer along the ''bottom-up'' route, the strain will be gradually relaxed and T{sub c} will increase as well, until the MIT behavior becomes the same as that of bulk material with a T{sub c} of about 68 C. Whereas, in this study, we find that the VO{sub 2}/TiO{sub 2} (001) film thinned by ''top-down'' wet-etching shows an abnormal variation in MIT, which accompanies the potential relaxation of film strain with thinning. It is observed that even when the strained VO{sub 2} film is etched up to several nanometers, the MIT persists, and T{sub c} will increase up to that of bulk material, showing the trend to a stress-free ultra-thin VO{sub 2} film. The current findings demonstrate a facial chemical-etching way to change interfacial strain and modulate the phase transition behavior of ultrathinVO{sub 2} films, which can also be applied to other strained oxide films. (copyright 2017 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

Nuclear localization of human DNA mismatch repair protein exonuclease 1 (hEXO1)

DEFF Research Database (Denmark)

Knudsen, Nina Østergaard; Nielsen, Finn Cilius; Vinther, Lena

2007-01-01

interaction with hMLH1 and we show that defective nuclear localization of hEXO1 mutant proteins could be rescued by hMLH1 or hMSH2. Both hEXO1 and hMLH1 form complexes with the nuclear import factors importin beta/alpha1,3,7 whereas hMSH2 specifically recognizes importin beta/alpha3. Taken together, we infer...... that hEXO1, hMLH1 and hMSH2 form complexes and are imported to the nucleus together, and that redundant NLS import signals in the proteins may safeguard nuclear import and thereby MMR activity....

High-pressure single-crystal elasticity study of CO{sub 2} across phase I-III transition

Energy Technology Data Exchange (ETDEWEB)

Zhang, Jin S., E-mail: zhang72@illinois.edu; Bass, Jay D. [Department of Geology, University of Illinois, Urbana-Champaign, Illinois 61801 (United States); Shieh, Sean R. [Departments of Earth Sciences and Physics and Astronomy, University of Western Ontario, London, Ontario N6A 5B7 (Canada); Dera, Przemyslaw [Hawaii Institute of Geophysics and Planetology, University of Hawaii at Manoa, Honolulu, Hawaii 96822 (United States); Prakapenka, Vitali [Center for Advanced Radiation Sources, University of Chicago, Chicago, Illinois 60637 (United States)

2014-04-07

Sound velocities and elastic moduli of solid single-crystal CO{sub 2} were measured at pressures up to 11.7(3) GPa by Brillouin spectroscopy. The aggregate adiabatic bulk modulus (K{sub S}), shear modulus (G), and their pressure derivatives for CO{sub 2} Phase I are K{sub S0} = 3.4(6) GPa, G{sub 0} = 1.8(2) GPa, (dK{sub S}/dP){sub 0} = 7.8(3), (dG/dP){sub 0} = 2.5(1), (d{sup 2}K{sub S}/dP{sup 2}){sub 0} = −0.23(3) GPa{sup −1}, and (d{sup 2}G/dP{sup 2}){sub 0} = −0.10(1) GPa{sup −1}. A small increase of elastic properties was observed between 9.8(1) and 10.5(3) GPa, in agreement with the CO{sub 2} I-III transition pressure determined from previous x-ray diffraction experiments. Above the transition pressure P{sub T}, we observed a mixture dominated by CO{sub 2}-I, with minor CO{sub 2}-III. The CO{sub 2}-I + III mixture shows slightly increased sound velocities compared to pure CO{sub 2}-I. Elastic anisotropy calculated from the single-crystal elasticity tensor exhibits a decrease with pressure beginning at 7.9(1) GPa, which is lower than P{sub T}. Our results coincide with recent X-ray Raman observations, suggesting that a pressure-induced electronic transition is related to local structural and optical changes.

High-level Computational Study of the Site-, Facial- and Stereoselectivities for the Diels-Alder Reaction Between o-Benzoquinone and Norbornadiene

Directory of Open Access Journals (Sweden)

Ronald N. Warrener

2000-12-01

Full Text Available Ab initio and DFT quantum chemical calculations have been applied to a study of the Diels-Alder reaction of o-benzoquinone as diene and norbornadiene as dienophile. Transition states for the different reactions are located and activation energies estimated. The prefered exo-π-facial selectivity and exo,endo-stereoselectivity exhibited in this cycloaddition are readily predicted using RHF/3-21G or higher levels of calculations. Differences between experimentally observed results and calculations may be explained by the postulation of a second, nonconcerted biradical mechanism leading to formation of hetero Diels-Alder products.

Canted spin structure and the first order magnetic transition in CoFe{sub 2}O{sub 4} nanoparticles coated by amorphous silica

Energy Technology Data Exchange (ETDEWEB)

Lyubutin, I.S. [Shubnikov Institute of Crystallography, Russian Academy of Sciences, Moscow 119333 (Russian Federation); Starchikov, S.S., E-mail: sergey.s.starchikov@gmail.com [Shubnikov Institute of Crystallography, Russian Academy of Sciences, Moscow 119333 (Russian Federation); Gervits, N.E.; Korotkov, N.Yu.; Dmitrieva, T.V. [Shubnikov Institute of Crystallography, Russian Academy of Sciences, Moscow 119333 (Russian Federation); Lin, Chun-Rong, E-mail: crlinspin@gmail.com [Department of Applied Physics, National Pingtung University, Pingtung County 90003, Taiwan (China); Tseng, Yaw-Teng [Department of Applied Physics, National Pingtung University, Pingtung County 90003, Taiwan (China); Shih, Kun-Yauh [Department of Applied Chemistry, National Pingtung University, Pingtung County 90003, Taiwan (China); Lee, Jiann-Shing [Department of Applied Physics, National Pingtung University, Pingtung County 90003, Taiwan (China); Wang, Cheng-Chien [Department of Chemical and Materials Engineering, Southern Taiwan University of Science and Technology, Tainan 710, Taiwan (China)

2016-10-01

The functional polymer (PMA-co-MAA) latex microspheres were used as a core template to prepare magnetic hollow spheres consisting of CoFe{sub 2}O{sub 4}/SiO{sub 2} composites. The spinel type crystal structure of CoFe{sub 2}O{sub 4} ferrite is formed under annealing, whereas the polymer cores are completely removed after annealing at 450 °C. Magnetic and Mössbauer spectroscopy measurements reveal very interesting magnetic properties of the CoFe{sub 2}O{sub 4}/SiO{sub 2} hollow spheres strongly dependent on the particle size which can be tuned by the annealing temperature. In the ground state of low temperatures, the CoFe{sub 2}O{sub 4} nanoparticles are in antiferromagnetic state due to the canted magnetic structure. Under heating in the applied field, the magnetic structure gradually transforms from canted to collinear, which increases the magnetization. The Mössbauer data revealed that the small size CoFe{sub 2}O{sub 4}/SiO{sub 2} particles (2.2–4.3 nm) do not show superparamagnetic behavior but transit from the magnetic to the paramagnetic state by a jump-like magnetic transition of the first order This effect is a specific property of the magnetic nanoparticles isolated by inert material, and can be initiated by internal pressure creating at the particle surface. The suggested method of synthesis can be modified with various bio-ligands on the silane surface, and such materials can find many applications in diagnostics and bio-separation. - Highlights: • CoFe{sub 2}O{sub 4}/SiO{sub 2} nanocomposites in shell of hollow microcapsules designed for biomedical applications • The CoFe{sub 2}O{sub 4} particle size and magnetic properties can be tuned by thermal treatment • Canted spin structure in the CoFe{sub 2}O{sub 4} nanoparticles coated by SiO{sub 2} • The first order magnetic transition in the CoFe{sub 2}O{sub 4} nanoparticles coated by silica.

The system study of 1:13 phase formation, the magnetic transition adjustment, and magnetocaloric property in La(Fe,Co){sub 13−x}Si{sub x} alloys

Energy Technology Data Exchange (ETDEWEB)

Chen, Xiang, E-mail: gxucx@163.com [School of Materials Science and Engineering, Sichuan University, Chengdu 610065 (China); Department of Physics and Electronic Informational Engineering, Neijiang Teachers College, Neijiang 641002 (China); Chen, Yungui, E-mail: ygchen60@yahoo.com.cn [School of Materials Science and Engineering, Sichuan University, Chengdu 610065 (China); Tang, Yongbo; Xiao, Dingquan [School of Materials Science and Engineering, Sichuan University, Chengdu 610065 (China)

2014-11-15

The effects of Co on the formation of NaZn{sub 13}-type phase in as-cast and annealed LaFe{sub 16−x}Co{sub x}Si{sub 1.4} and LaFe{sub 11.6}Si{sub 1.4−x}Co{sub x} alloys have been investigated systematically by XRD, SEM, and EDS, respectively. In LaFe{sub 11.6}Si{sub 1.4−x}Co{sub x} alloys, the introduction of Co will hamper the formation of 1:13 and LaFeSi phases, and help the formation of αof (Co, Si) solid solution, so there is almost only α-Fe(Co, Si) solid solution when x reaches 0.7 in as-cast and annealed LaFe{sub 11.6}Si{sub 1.4−x}Co{sub x} alloys. Although the amounts of 1:13 phase increases when x reaches 0.7 in as-cast LaFe{sub 16−x}Co{sub x}Si{sub 1.4} alloys, there is a small amount of α-Fe in LaFe{sub 11.6−x}Co{sub x}Si{sub 1.4} alloys annealed at 1523 K (5 h), which indicates that the annealing time for obtaining a 1:13 single-phase cannot be shortened in our high-temperature and short-time annealing. The studies on the magnetic properties show that the Curie temperature T{sub C} goes up from 207 K to 285 K with increase of Co content from x=0.1 to 0.8. The introduction of Co element weakens the first order magnetic phase transition, which results in the change of magnetic transition type from first to second order at about x=0.3–0.5. At the same time, it has effects on the phase transition temperature interval and magnetic filed interval, and the changing rate of magnetic entropy change dependence on the Co content in LaFe{sub 16−x}Co{sub x}Si{sub 1.4} alloys. The maximum entropy values of LaFe{sub 11.6−x}Co{sub x}Si{sub 1.4} alloys decrease with the increase of Co content, but the relative cooling power does not decrease, the reason of which is that the phase transition temperature interval increases and the first order phase transition character decreases, and the effective refrigeration temperature range becomes big, which is useful to the application of magnetic refrigeration material. - Highlights: • The introduction of Co

The exo-metabolome in filamentous fungi

DEFF Research Database (Denmark)

Thrane, Ulf; Andersen, Birgitte; Frisvad, Jens Christian

2007-01-01

Filamentous fungi are a diverse group of eukaryotic microorganisms that have a significant impact on human life as spoilers of food and feed by degradation and toxin production. They are also most useful as a source of bulk and fine chemicals and pharmaceuticals. This chapter focuses on the exo-metabolome...

Structural and magnetic properties and superconductivity in Ba(Fe<sub>1-xsub>TM_x)>2sub>As>2sub>

Energy Technology Data Exchange (ETDEWEB)

Thaler, Alexander [Iowa State Univ., Ames, IA (United States)

2012-01-01

We studied the effects on structural and magnetic phase transitions and the emergence of superconductivity in transition metal substituted BaFe<sub>2sub>As>2sub>. We grew four series of Ba(Fe<sub>1-xsub>TM>2sub>)>2sub>As>2sub> (TM=Ru, Mn, Co+Cr and Co+Mn) and characterized them by crystallographic, magnetic and transport measurements. We also subjected Ba(Fe<sub>1-xsub>Cr_x)>2sub>As>2sub> and Ba(Fe<sub>1-xsub>Co_x)>2sub>As>2sub> to heat treatment to explore what changes might be induced.

Energetics of bacterial photosynthesis.

Science.gov (United States)

Lebard, David N; Matyushov, Dmitry V

2009-09-10

We report the results of extensive numerical simulations and theoretical calculations of electronic transitions in the reaction center of Rhodobacter sphaeroides photosynthetic bacterium. The energetics and kinetics of five electronic transitions related to the kinetic scheme of primary charge separation have been analyzed and compared to experimental observations. Nonergodic formulation of the reaction kinetics is required for the calculation of the rates due to a severe breakdown of the system ergodicity on the time scale of primary charge separation, with the consequent inapplicability of the standard canonical prescription to calculate the activation barrier. Common to all reactions studied is a significant excess of the charge-transfer reorganization energy from the width of the energy gap fluctuations over that from the Stokes shift of the transition. This property of the hydrated proteins, breaking the linear response of the thermal bath, allows the reaction center to significantly reduce the reaction free energy of near-activationless electron hops and thus raise the overall energetic efficiency of the biological charge-transfer chain. The increase of the rate of primary charge separation with cooling is explained in terms of the temperature variation of induction solvation, which dominates the average donor-acceptor energy gap for all electronic transitions in the reaction center. It is also suggested that the experimentally observed break in the Arrhenius slope of the primary recombination rate, occurring near the temperature of the dynamical transition in proteins, can be traced back to a significant drop of the solvent reorganization energy close to that temperature.

First identification of the 0{sub 2}{sup +} state in {sup 30}Mg via its E0 transition

Energy Technology Data Exchange (ETDEWEB)

Schwerdtfeger, Wolfgang Norbert Erik

2008-08-28

The known 1789 keV level in {sup 30}Mg turned out to be a candidate for the 0{sub 2}{sup +} state due to its long lifetime of 3.9(4) ns and the absence of a {gamma} transition to the ground state. This triggered our search on the 0{sub 2}{sup +}{yields}0{sub 1}{sup +} E0 transition in {sup 30}Mg following the {beta} decay of {sup 30}Na: {beta} decay electrons were detected in a scintillation detector, while conversion electrons were focused onto a cooled Si(Li) detector using a Mini-Orange and detected with high resolution, which simultaneously suppresses the high background of {beta} decay electrons. Due to the large Q value of the {beta} decay of {sup 30}Na (17.3 MeV) the suppression of the coincident background induced by high-energy {gamma} rays and subsequently Compton-scattered electrons turned out to be the key challenge for the success of this experiment. In order to optimise the background suppression and thus the sensitivity to weak E0 transitions, offline test measurements using an {sup 90}Y and a {sup 152}Eu source were performed together with GEANT4 simulations. Resulting from these test measurements a highly sensitive experimental setup was designed and built, consequently minimising the amount of high-Z material in the target chamber, reducing X-ray production. As a by-product from test measurements the database value of the half-life of the 0{sub 2}{sup +} state in {sup 90}Zr could be corrected by more than 30 % to be t{sub 1/2}=41(1) ns. Finally, in a {beta} decay experiment at the ISOLDE facility at CERN the 0{sub 2}{sup +}{yields}0{sub 1}{sup +} E0 transition in {sup 30}Mg could be identified at the expected transition energy of 1788 keV proving for the first time shape coexistence at the borderline of the 'Island of Inversion'. This identification allows to determine the electric monopole strength as {rho}{sup 2}(E0)=26.2(7.5) x 10{sup -3}, indicating a rather weak mixing between the states in two potential minima in a simplified two-level

Purification, Kinetic, and Thermodynamic Characteristics of an Exo-polygalacturonase from Penicillium notatum with Industrial Perspective.

Science.gov (United States)

Amin, Faiza; Bhatti, Haq Nawaz; Bilal, Muhammad; Asgher, Muhammad

2017-09-01

An extracellular exo-polygalacturonase (exo-PG) produced by Penicillium notatum was purified (3.07-folds) by ammonium sulfate fractionation, ion exchange, and gel filtration chromatography. Two distinct isoforms of the enzyme, namely exo-PGI and exo-PGII, were identified during column purification with molecular weights of 85 and 20 kDa, respectively, on sodium dodecyl sulfate polyacrylamide gel electrophoresis (SDS-PAGE). The enzyme displayed its optimum activity at pH 6.0 and 50 °C and was found to be stable in the slightly acidic pH (ranging from 4.5 to 6.0). Michaelis-Menten parameters, i.e., K m (app) and V max for pectin hydrolysis, were calculated to be 16.6 mg/mL and 20 μmol/mL/min, respectively. The enzyme followed biphasic deactivation kinetics. Phase I of the exo-PGI showed half-lives of 6.83 and 2.39 min at 55 and 80 °C, respectively, whereas phase II of the enzyme exhibited a half-life of 63.57 and 22.72 min at 55 and 80 °C, respectively. The activation energy for denaturation was 51.66 and 44.06 kJ/mol for phase I and phase II of the exo-PGI, respectively. The enzyme activity was considerably enhanced by Mn 2+ , whereas exposure to a hydrophobic environment (urea and sodium azide solution) drastically suppressed the enzyme activity. Results suggest that exo-PGI might be considered as a potential candidate for various applications, particularly in the food and textile industries.

Comparison of fluctuating potentials and donor-acceptor pair transitions in a Cu-poor Cu{sub 2}ZnSnS{sub 4} based solar cell

Energy Technology Data Exchange (ETDEWEB)

Teixeira, J. P.; Sousa, R. A.; Sousa, M. G.; Cunha, A. F. da; Leitão, J. P., E-mail: joaquim.leitao@ua.pt [Departamento de Física and I3N, Universidade de Aveiro, 3810-193 Aveiro (Portugal); Fernandes, P. A. [Departamento de Física and I3N, Universidade de Aveiro, 3810-193 Aveiro (Portugal); Departamento de Física, Instituto Superior de Engenharia do Porto, Instituto Politécnico do Porto, Rua Dr. António Bernardino de Almeida, 431, 4200-072 Porto (Portugal); Salomé, P. M. P. [INL - International Iberian Nanotechnology Laboratory, Laboratory for Nanostructured Solar Cells (LaNaSC), Av. Mestre José Veiga, 4715-330 Braga (Portugal); González, J. C. [Departamento de Física, Universidade Federal de Minas Gerais, 30123-970 Belo Horizonte, Minas Gerais (Brazil)

2014-10-20

The structure of the electronic energy levels of a single phase Cu{sub 2}ZnSnS{sub 4} film, as confirmed by Raman Scattering and x-ray diffraction, is investigated through a dependence on the excitation power of the photoluminescence (PL). The behavior of the observed asymmetric band, with a peak energy at ∼1.22 eV, is compared with two theoretical models: (i) fluctuating potentials and (ii) donor-acceptor pair transitions. It is shown that the radiative recombination channels in the Cu-poor film are strongly influenced by tail states in the bandgap as a consequence of a heavy doping and compensation levels. The contribution of the PL for the evaluation of secondary phases is also highlighted.

Habitability on Early Mars and the Search for Biosignatures with the ExoMars Rover

Science.gov (United States)

Westall, Frances; Coates, Andrew J.; Jaumann, Ralf; Korablev, Oleg; Ciarletti, Valérie; Mitrofanov, Igor; Josset, Jean-Luc; De Sanctis, Maria Cristina; Bibring, Jean-Pierre; Goesmann, Fred; Steininger, Harald; Brinckerhoff, William; Szopa, Cyril; Raulin, François; Westall, Frances; Edwards, Howell G. M.; Whyte, Lyle G.; Fairén, Alberto G.; Bibring, Jean-Pierre; Bridges, John; Hauber, Ernst; Ori, Gian Gabriele; Werner, Stephanie; Loizeau, Damien; Kuzmin, Ruslan O.; Williams, Rebecca M. E.; Flahaut, Jessica; Forget, François; Rodionov, Daniel; Korablev, Oleg; Svedhem, Håkan; Sefton-Nash, Elliot; Kminek, Gerhard; Lorenzoni, Leila; Joudrier, Luc; Mikhailov, Viktor; Zashchirinskiy, Alexander; Alexashkin, Sergei; Calantropio, Fabio; Merlo, Andrea; Poulakis, Pantelis; Witasse, Olivier; Bayle, Olivier; Bayón, Silvia; Meierhenrich, Uwe; Carter, John; García-Ruiz, Juan Manuel; Baglioni, Pietro; Haldemann, Albert; Ball, Andrew J.; Debus, André; Lindner, Robert; Haessig, Frédéric; Monteiro, David; Trautner, Roland; Voland, Christoph; Rebeyre, Pierre; Goulty, Duncan; Didot, Frédéric; Durrant, Stephen; Zekri, Eric; Koschny, Detlef; Toni, Andrea; Visentin, Gianfranco; Zwick, Martin; van Winnendael, Michel; Azkarate, Martín; Carreau, Christophe

2017-01-01

Abstract The second ExoMars mission will be launched in 2020 to target an ancient location interpreted to have strong potential for past habitability and for preserving physical and chemical biosignatures (as well as abiotic/prebiotic organics). The mission will deliver a lander with instruments for atmospheric and geophysical investigations and a rover tasked with searching for signs of extinct life. The ExoMars rover will be equipped with a drill to collect material from outcrops and at depth down to 2 m. This subsurface sampling capability will provide the best chance yet to gain access to chemical biosignatures. Using the powerful Pasteur payload instruments, the ExoMars science team will conduct a holistic search for traces of life and seek corroborating geological context information. Key Words: Biosignatures—ExoMars—Landing sites—Mars rover—Search for life. Astrobiology 17, 471–510.

Magnetostructural Phase Diagram of Multiferroic (ND<sub>4sub>)>2sub>FeCl>5sub>.H>2sub>O

Energy Technology Data Exchange (ETDEWEB)

Clune, A. [Univ. of Tennessee, Knoxville, TN (United States); Hughey, K. [Univ. of Tennessee, Knoxville, TN (United States); Musfeldt, J. L. [Univ. of Tennessee, Knoxville, TN (United States); Tian, W. [Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States); Fernandez-Baca, J. [Oak Ridge National Lab. (ORNL), Oak Ridge, TN (United States); Singleton, John [Los Alamos National Lab. (LANL), Los Alamos, NM (United States)

2017-02-13

Spin and polarization flop transitions are fascinating, especially when controlled by external stimuli like magnetic and electric field and accompanied by large material responses involving multiple degrees of freedom. Multiferroics like MnWO<sub>4sub>, TbMnO<sub>3sub>, and Ni<sub>3sub>TeO>6sub> are flagship examples and owe their remarkable properties, for instance field control of polarization and polarization flops combined with spin helix reorientation, to the anisotropy and heavy centers that bring in spin-orbit coupling. The family of A<sub>2sub>FeX>5sub>.H>2sub>O erythrosiderites (A = K, Rb, NH<sub>4sub>; B = Fe, Mn, Co; X = Cl, Br, H<sub>2sub>O) drew our attention due to the rich chemical tuning possibilities, complex phase diagrams, and topological similarities to oxide multiferroics.1 (NH<sub>4sub>)>2sub>FeCl>5sub>.H>2sub>O is the flagship example (Fig. 1(a)). It displays a high temperature order-disorder transition involving long-range hydrogen bonding of the NH<sub>4sub>⁺ group and two successive low temperature magnetic transitions below which non-collinear magnetic order and ferroelectricity are established.1 In addition to the magnetically-induced electric polarization that arises below 6.9 K (P = 3 μC/m<sub>2sub> along a and a smaller component along b), applied field reveals a peculiar hysteretic spin flop transition near 4.5 T above which polarization flops from the a- to the c-axis. There are elastic components as well. Taken together, these findings raise questions about the interactions that induce this behavior and whether additional non-equilibrium phases might be accessed under even higher magnetic fields.

Dielectric properties in the vicinity of the ferroelectric phase transition in a mixed crystal of deuterated betaine phosphate{sub 0.03} betaine phosphite{sub 0.97}

Energy Technology Data Exchange (ETDEWEB)

Banys, J.; Macutkevic, J.; Kajokas, A.; Brilingas, A.; Grigas, J. [Faculty of Physics, Vilnius University, Sauletekio 9, Vilnius 2040 (Lithuania); Klimm, C.; Voelkel, G. [Fakultaet fuer Physik und Geowissenschaften, Universitaet Leipzig, Linnestr. 5, 04103 Leipzig (Germany)

2004-02-01

The dielectric behaviour of ferroelectric hydrogen bonded deuterated betaine phosphate{sub 0.03} betaine phosphite{sub 0.97} (DBP{sub 0.03}DBPI{sub 0.97})is investigated in the region of the ferroelectric phase transition. Dielectric dispersion is investigated in the frequency range up to 12 GHz. The dielectric dynamics shows a critical slowing down. The frequency of the relaxational soft mode in the paraelectric phase varies according to the quasi-one-dimensional Ising model and decreases up to 0.31 GHz at the phase transition temperature (T{sub C}=272 K). The obtained activation energy for the deuteron flipping motion {delta}U=2.3kT{sub C}=0.054 eV shows the order-disorder character of the ferroelectric phase transition. The spontaneous polarisation, obtained from pyroelectric measurements, is also well explained using the quasi-one-dimensional Ising model. At low temperatures, the freezing phenomena in DBP{sub 0.03}DBPI{sub 0.97} revealed the complex dielectric permittivity behaviour characteristic for the transition into the dipolar glass state. The activation energy of this low temperature process was found to be E{sub b}=1297 K (0.041 eV) and the glass temperature was estimated to 73 K. (copyright 2004 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim) (orig.)

Moessbauer studies of the structural phase transitions in RbFeF/sub 4/

Energy Technology Data Exchange (ETDEWEB)

Baumeler, Hp.; Keller, H.; Kuendig, W.; Savic, I.M.; Wanklyn, B.M.

1984-03-20

RbFeF/sub 4/ exhibits two structural phase transitions (SPT), namely a first-order transition at 381 K and a second-order transition at 417 K. A detailed /sup 57/Fe Moessbauer investigation of these SPT is presented. At pronounced discontinuities in the quadrupole splitting and the recoil-free fraction are observed, whereas at 417 K both quantities vary continuously with temperature. Both SPT are also seen in the area ratio of the single crystal quadrupole lines which reflects the tilting of the FeF/sub 6/ octahedra with respect to the c-axis. However, no noticeable indication of the SPT is found in the center shift.

Synchrotron radiation topography studies of the phase transition in LaGaO sub 3 crystals

Energy Technology Data Exchange (ETDEWEB)

Yao, G.D.; Dudley, M. (Dept. of Materials Science and Engineering, SUNY at Stony Brook, NY (USA)); Wang, Y.; Liu, X.; Liebermann, R.C. (Dept. of Earth and Space Sciences, SUNY at Stony Brook, NY (USA))

1991-05-01

An investigation of the orthorhombic to rhombohedral phase transformation occurring at 145degC in lanthanum gallate has been conducted using white beam synchrotron X-ray topography (WBSXRT). The existence of the first order transition was confirmed by differential thermal analysis and X-ray diffractometer powder analysis. Subsequent to this, synchrotron white beam Laue patterns were recorded in situ as a function of temperature, during the transition. Before the transition point was reached, (112){sub orth} type reflection twinning was found to be dominant although a small amount of (110){sub orth} type twinning was also observed in the same crystal. Beyond the transition point, not only did the structural change become evident but also reflection twinning on the (110){sub rhom} planes was observed. The scale of this twinning became finer as the temperature was increased beyond the transition temperature. The twinning observed in both the low and high temperature phases gives rise to deformation of the (011){sub rhom} surface plane which creates problems for the potential use of this material as a substrate for growing high Tc superconducting epitaxial layers. (orig.).

Metal-insulator transition upon heating and negative-differential-resistive-switching induced by self-heating in BaCo{sub 0.9}Ni{sub 0.1}S{sub 1.8}

Energy Technology Data Exchange (ETDEWEB)

Fisher, B.; Genossar, J.; Chashka, K. B.; Patlagan, L.; Reisner, G. M. [Physics Department, Technion-Israel Institute of Technology, Haifa 32000 (Israel)

2014-04-14

The layered compound BaCo{sub 1−x}Ni{sub x}S{sub 2−y} (0.05 < x < 0.2 and 0.05 < y < 0.2) exhibits an unusual first-order structural and electronic phase transition from a low-T monoclinic paramagnetic metal to a high-T tetragonal antiferromagnetic insulator around 200 K with huge hysteresis (∼40 K) and large volume change (∼0.01). Here, we report on unusual voltage-controlled resistive switching followed by current-controlled resistive switching induced by self-heating in polycrystalline BaCo{sub 1−x}Ni{sub x}S{sub 2−y} (nominal x = 0.1 and y = 0.2). These were due to the steep metal to insulator transition upon heating followed by the activated behavior of the resistivity above the transition. The major role of Joule heating in switching is supported by the absence of nonlinearity in the current as function of voltage, I(V), obtained in pulsed measurements, in the range of electric fields relevant to d.c. measurements. The voltage-controlled negative differential resistance around the threshold for switching was explained by a simple model of self-heating. The main difficulty in modeling I(V) from the samples resistance as function of temperature R(T) was the progressive increase of R(T), and to a lesser extend the decrease of the resistance jumps at the transitions, caused by the damage induced by cycling through the transitions by heating or self-heating. This was dealt with by following systematically R(T) over many cycles and by using the data of R(T) in the heating cycle closest to that of the self-heating one.

Photoreflectance study of the near-band-edge transitions of chemical vapor deposition-grown mono- and few-layer MoS{sub 2} films

Energy Technology Data Exchange (ETDEWEB)

Lin, Kuang-I, E-mail: kilin@mail.ncku.edu.tw [Center for Micro/Nano Science and Technology, National Cheng Kung University, Tainan 70101, Taiwan (China); Chen, Yen-Jen; Wang, Bo-Yan; Cheng, Yung-Chen [Department of Materials Science, National University of Tainan, Tainan 70005, Taiwan (China); Chen, Chang-Hsiao, E-mail: chsiaoc@fcu.edu.tw [Department of Automatic Control Engineering, Feng Chia University, Taichung 40724, Taiwan (China)

2016-03-21

Room-temperature photoreflectance (PR) and reflectance (R) spectroscopy are utilized to investigate the near-band-edge transitions of molybdenum disulfide (MoS{sub 2}) thin films grown on sapphire substrates by a hot-wall chemical vapor deposition system. The layer thickness and optical properties of the MoS{sub 2} thin films are confirmed by Raman spectroscopy, atomic force microscope, and photoluminescence (PL) analysis. The B exciton shows relatively weak PL intensity in comparing with the A exciton even for monolayer MoS{sub 2} films. In the R spectrum of few‐layer MoS{sub 2}, it is not possible to clearly observe exciton related features. The PR spectra have two sharp, derivative-like features on a featureless background. Throughout the PR lineshape fitting, the transition energies are designated as the A and B excitons at the K-point of the Brillouin zone, but at room temperature there seems to be no distinguishable feature corresponding to an H‐point transition for the mono- and few-layer MoS{sub 2} films unlike in bulk. These transition energies are slightly larger than those obtained by PL, which is attributed to the Stokes shifts related to doping level. The obtained values of valence-band spin-orbit splitting are in good agreement with those from other experimental methods. By comparing the PR lineshapes, the dominant modulation mechanism is attributed to variations of the exciton transition energies due to change in the built-in electric field. On the strength of this study, PR spectroscopy is demonstrated as a powerful technique for characterizing the near-band-edge transitions of MoS{sub 2} from monolayer to bulk.

Phase transition and enhanced magneto-dielectric response in BiFeO{sub 3}-DyMnO{sub 3} multiferroics

Energy Technology Data Exchange (ETDEWEB)

Tripathy, Satya N., E-mail: satyanarayantripathy@gmail.com; Pradhan, Dillip K., E-mail: dillip.pradhan79@gmail.com [Department of Physics and Astronomy, National Institute of Technology, Rourkela 769008 (India); Pradhan, Dhiren K.; Palai, Ratnakar; Katiyar, Ram S. [Department of Physics and Institute for Functional Nanomaterials, University of Puerto Rico, San Juan, Puerto Rico 00936 (United States); Mishra, Karuna K. [Condensed Matter Physics Division, Indira Gandhi Centre for Atomic Research, Kalpakkam 603102 (India); Sen, Shrabanee [Sensor and Actuator Division, Central Glass and Ceramics Research Institute, Kolkata 700032 (India); Paulch, Marian [Institute of Physics, University of Silesia, Uniwersytecka 4, 40-007 Katowice (Poland); Scott, James F. [Department of Physics, Cavendish Laboratory, University of Cambridge, Cambridge CB3 OHE (United Kingdom)

2015-04-14

We report systematic studies on crystal structure and magneto-dielectric properties of (1 − x) BiFeO{sub 3}-x DyMnO{sub 3} (0.0 ≤ x ≤ 0.2) nanoceramics synthesized by auto-combustion method. Rietveld refinement of X-ray diffraction data indicates a structural transition from R3c to R3c + Pn2{sub 1}a at x = 0.1. Field emission scanning electron micrographs display a decrease in grain size with increase in x. The presence of dielectric anomalies around antiferromagnetic transition temperature implies the magnetoelectric coupling. Dielectric measurements showed decrease in magnetic ordering temperature with increasing x in agreement with differential scanning calorimetry results. A significant increase in magnetization has been found with increasing DyMnO{sub 3} substitution. Magneto-impedance spectroscopy reveals a significant change (∼18%) in dielectric permittivity at H = 2 T for x = 0.2.

Experiment study about phase transition characteristics of CO{sub 2} in low-permeable porous media

Energy Technology Data Exchange (ETDEWEB)

Guo, P.; Wang, J.; Luo, Y. [State Key Laboratory of Oil and Gas Reservoir Geology and Exploitation, Chengdu (China); Southwest Petroleum Univ., Chengdu (China); Fan, J.M. [PetroChina, Xian (China). Ultra-low Permeability Reservoir Research Inst.

2009-07-01

This paper described an experimental study conducted to characterize phase changes in carbon dioxide (CO{sub 2}) that occur during CO{sub 2} sequestration and enhanced oil recovery (EOR) processes. An ultrasonic testing method was used to determine the influence of pressure and temperature on core fluids. Phase transitions were characterized by collecting time series of ultrasonic signals in a data acquisition system and calculating the correlation dimension of the phase space. A correlation dimension analysis method was used with a fractal theory to develop correlation curves for the phase transition characteristics of CO{sub 2} in porous media. The study demonstrated that below a critical temperature, the existence of porous media can increase the phase transition point of CO{sub 2}. Above the critical temperature, the existence of porous media decreased the inflection point in the pressure-volume relationship curve for CO{sub 2}. Time difference changes were also more apparent above the critical temperature. 11 refs., 2 tabs., 11 figs.

Levels and transitions in /sup 204/Pb and the four valence neutron-hole configurations

International Nuclear Information System (INIS)

Hanly, J.M.; Hicks, S.E.; McEllistrem, M.T.; Yates, S.W.

1988-01-01

Levels of the nucleus /sup 204/Pb have been investigated using the (n,n'γ) reaction, and γ rays from low-spin excited levels have been observed. Forty-three low-spin levels connected by 78 γ rays are found below 2.9 MeV, whereas only about 28 levels had previously been known. The levels below 2 MeV excitation energy are expected to be dominated by the p/sub 1/2/, f/sub 5/2/, and p/sub 3/2/ valence neutron hole excitations, and 0 + levels at 0, 1730, and 2433.1 keV are associated primarily with these configurations. These states are at almost the same excitation energies as parent 0 + excitations in /sup 206/Pb. Approximately six unnatural-parity levels are identified; this is close to the number predicted in six orbit valence-space shell model calculations. The number of natural-parity levels found, however, is almost twice that calculated with the shell model. Levels and transitions below 2 MeV excitation energy are consistent with expectations basing /sup 204/Pb states on correlated two-hole excitations dominant in /sup 206/Pb

A novel base-induced isomerization gives access to unprecedented (E)-exo-glycals.

Science.gov (United States)

Eppe, Guillaume; Dumitrescu, Lidia; Pierrot, Olivier; Li, Tianlei; Pan, Weidong; Vincent, Stéphane P

2013-08-26

Bump the base: This study reports the discovery of the base-induced Z-to-E isomerization of exo-glycals bearing an electron-withdrawing group (EWG). The scope of this novel transformation regarding the carbohydrate unit is also discussed. After elucidating the mechanism, preparation of novel (E)-exo- glycals was performed (TBS = tert-butyldimethylsilyl). Copyright © 2013 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

Large modification in insulator-metal transition of VO{sub 2} films grown on Al{sub 2}O{sub 3} (001) by high energy ion irradiation in biased reactive sputtering

Energy Technology Data Exchange (ETDEWEB)

Azhan, Nurul Hanis; Okimura, Kunio, E-mail: okifn@keyaki.cc.u-tokai.ac.jp [Graduate School of Science and Technology, Tokai University, Hiratsuka 259-1292 (Japan); Ohtsubo, Yoshiyuki; Kimura, Shin-ichi [Graduate School of Frontier Biosciences, Osaka University, Suita 565-0871 (Japan); Zaghrioui, Mustapha; Sakai, Joe [GREMAN, UMR 7347 CNRS, Université François Rabelais de Tours, Parc de Grandmont, 37200 Tours (France)

2016-02-07

High energy ion irradiation in biased reactive sputtering enabled significant modification of insulator-metal transition (IMT) properties of VO{sub 2} films grown on Al{sub 2}O{sub 3} (001). Even at a high biasing voltage with mean ion energy of around 325 eV induced by the rf substrate biasing power of 40 W, VO{sub 2} film revealed low IMT temperature (T{sub IMT}) at 309 K (36 °C) together with nearly two orders magnitude of resistance change. Raman measurements from −193 °C evidenced that the monoclinic VO{sub 2} lattice begins to transform to rutile-tetragonal lattice near room temperature. Raman spectra showed the in-plane compressive stress in biased VO{sub 2} films, which results in shortening of V–V distance along a-axis of monoclinic structure, a{sub M}-axis (c{sub R}-axis) and thus lowering the T{sub IMT}. In respect to that matter, significant effects in shortening the in-plane axis were observed through transmission electron microscopy observations. V2p{sub 3/2} spectra from XPS measurements suggested that high energy ion irradiation also induced oxygen vacancies and resulted for an early transition onset and rather broader transition properties. Earlier band gap closing against the temperature in VO{sub 2} film with higher biasing power was also probed by ultraviolet photoelectron spectroscopy. Present results with significant modification of IMT behavior of films deposited at high-energy ion irradiation with T{sub IMT} near the room temperature could be a newly and effective approach to both exploring mechanisms of IMT and further applications of this material, due to the fixed deposition conditions and rather thicker VO{sub 2} films.

Microwave plasma generation and filtered transport of O{sub 2} (a {sup 1}{delta}{sub g})

Energy Technology Data Exchange (ETDEWEB)

Williams, Skip [Air Force Research Laboratory, Mail Stop PRAS, 1950 Fifth Street, WPAFB, OH 45433-7251 (United States); Popovic, Svetozar [Department of Physics, Old Dominion University, Norfolk, VA 23529 (United States); Gupta, Manish [Los Gatos Research, Incorporated 67 East Evelyn Ave, Suite 3, Mountain View, CA 94041 (United States)], E-mail: skip.williams@wpafb.af.mil

2009-08-01

Singlet oxygen, O{sub 2}(a {sup 1}{delta}{sub g}), is generated using a low pressure, low power continuous microwave discharge operating at 2.45 GHz with a flow of helium seeded with 1-10% molecular oxygen. The absolute concentration of O{sub 2}(a {sup 1}{delta}{sub g}) is measured using off-axis integrated cavity output spectroscopy to probe the Q-branch transition of the (1, 0) band of the b{sup 1}{sigma}{sub g}{sup +}-a{sup 1}{delta}{sub g} Noxon system. In order to remove other energetic species from the flow, the post-discharge flow is passed through a coarse fritted quartz filter. The use of the quartz frit takes advantage of the substantially lower surface sticking probability of O{sub 2}(a {sup 1}{delta}{sub g}) in comparison with other excited species on the flow. Up to 6% of the total oxygen passing through the filter remains in the a {sup 1}{delta}{sub g} state, and absolute densities of 2.5 x 10{sup 14} cm{sup -3} are obtained using this method. This preparation method and transport is important in developing sources of singlet oxygen for kinetic and spectroscopic studies.

Production, purification and characterization of an exo-polygalacturonase from Penicillium janthinellum sw09

Directory of Open Access Journals (Sweden)

YUPING MA

2016-01-01

Full Text Available ABSTRACT A soil isolate, Penicillium janthinellum sw09 has been found to produce significant amounts of an extracellular pectinase subsequently characterized as exo-polygalacturonase (exo-PG. By optimizing growth conditions, P. janthinellum sw09 produced high amount of exo-PG (16.54 units/mL. The crude enzyme was purified by gel filtration chromatography and two exo-PG activity peaks (designated as PGI and PGII were revealed. On SDS-PAGE analysis, purified PGII using DEAE-Sepharose FF column, was found to be a single band with a molecular mass of 66.2 kDa. The purified PGII exhibited maximal activity at the temperature of 45 oC and pH 5.0. The stability profiles show that PGII is more stable in the pH range of 4.0-8.0 and below 60 oC. The Km and Vmax for the enzyme was 1.74 mg/mL and 18.08 μmol/ (mL•min, respectively. Due to this enzymatic characterization, this pectinase is an attractive candidate for applications in degradation of pectin.

Crystal field excitations of YbMn{sub 2}Si{sub 2}

Energy Technology Data Exchange (ETDEWEB)

Mole, R.A. [Australian Nuclear Science and Technology Organisation, Lucas Heights, NSW 2234 (Australia); School of Physical, Environmental and Mathematical Sciences, The University of New South Wales at the Australian Defence Force Academy, Canberra, ACT 2600 (Australia); Hofmann, M. [School of Physical, Environmental and Mathematical Sciences, The University of New South Wales at the Australian Defence Force Academy, Canberra, ACT 2600 (Australia); Forschungsneutronenquelle Heinz Maier-Leibnitz (FRM II), Technische Universität München, 85747 Garching (Germany); Adroja, D.T. [ISIS Facility, Science and Technology Facilities Council, Rutherford Appleton Laboratory, Didcot, OX11 OQX (United Kingdom); Moze, O. [Dipartimento di Fisica, Università degli Studi di Modena e Reggio Emilia, Modena (Italy); Campbell, S.J., E-mail: stewart.campbell@adfa.edu.au [School of Physical, Environmental and Mathematical Sciences, The University of New South Wales at the Australian Defence Force Academy, Canberra, ACT 2600 (Australia)

2013-12-15

The crystal field excitations of the rare earth intermetallic compound YbMn{sub 2}Si{sub 2} have been measured by inelastic neutron scattering over the temperature range 2.5–50 K. The YbMn{sub 2}Si{sub 2} spectra exhibit three low energy excitations (∼3–7 meV) in the antiferromagnetic AFil region above the magnetic phase transition at T{sub N2} = 30(5) K. The crystal field parameters have been determined for YbMn{sub 2}Si{sub 2} in the antiferromagnetic AFil region. A further two inelastic excitations (∼9 meV, 17 meV) are observed below T{sub N2}=30(5) K, the temperature at which the high temperature antiferromagnetic structure is reported to exhibit doubling of the magnetic cell. Energy level diagrams have been determined for Yb{sup 3+} ions in the different sites above (single site) and below the magnetic transition temperature (two sites). The excitation energies for both sites are shown to be temperature independent with the temperature dependences of the transition intensities for the two sites described well by a simple Boltzmann model. The spectra below T{sub N2} cannot be described fully in terms of molecular field models based on either a single Yb{sup 3+} site or two Yb{sup 3+} sites. This indicates that the magnetic behaviour of YbMn{sub 2}Si{sub 2} is more complicated than previously considered. The inability to account fully for excitations below the magnetic phase transition may be due to an, as yet, unresolved structural transition associated with the magnetic transition. - Highlights: • The inelastic neutron scattering from YbMn{sub 2}Si{sub 2} has been investigated over the temperature range 2.5–50 K. • The crystal field splitting has been monitored through the magnetic transition at 30(5) K. • We have determined the crystal field parameters for the antiferromagnetic AFil region. • The transition intensities are described well by Boltzmann occupancy models. • The spectra below the magnetic transition have been analysed by

Tales to Transit : Sub-Saharan African Migrants’ Experiences in Istanbul

OpenAIRE

Suter, Brigitte

2012-01-01

This dissertation presents the transit experiences of migrants from Sub-Saharan African countries in the Turkish metropolis of Istanbul. Although the narratives of the individuals met in the course of fieldwork in Istanbul are the primary focus, the thesis also outlines the larger macro-structural conditions faced. The overarching goal of this thesis is thus, through the experiences of the migrants themselves, to critically approach and discuss the concept of transit with the aid of the theor...

ΔM/sub j/ transitions in homonuclear molecule scattering off corrugated surfaces. Square and rectangular lattice symmetry and purely repulsive interaction

International Nuclear Information System (INIS)

Proctor, T.R.; Kouri, D.J.; Gerber, R.B.

1984-01-01

In this paper, we present the first formal and computational studies of Δm/sub j/ transitions occurring in homonuclear molecule-corrugated surface collisions. The model potential is a pairwise additive one which correctly incorporates the fact that Δm/sub j/ transitions occur only for corrugated surfaces (provided the quantization axis is chosen to be the average surface normal). The principal results are: (a) Δm/sub j/ transitions are extremely sensitive to lattice symmetry; (b) strong selection rules obtain for specular scattering; (c) the magnitude of Δm/sub j/ -transition probabilities are strongly sensitive to surface corrugation; (d) the Δm/sub j/ transitions depend strongly on diffraction peak; (e) the ratio of molecular length to lattice dimension (r/a) has a strong influence on the magnitude of Δm/sub j/ -transition probabilities [with the probabilities increasing as (r/a) increases]; (f) Δm/sub j/ rainbows are predicted to occur as a function of the (r/a) ratio increases; (g) Δm/sub j/ transitions and the Δm/sub j/ rainbow are expected to accompany Δj-rotational rainbows; (h) such magnetic transition rainbows accompanying Δj rainbows are suggested as an explanation of recent experimental observations of quenching of NO polarization for larger Δj transitions in NO/Ag(111) scattering

Status, problems and perspectives of the education on nuclear energetics and nuclear safety within the Technical University of Sofia

International Nuclear Information System (INIS)

Lakov, M.; Bonev, B.; Stoyanov, S.; Velev, V.

2004-01-01

Education on nuclear energetic within the Technical University of Sofia is conducted since 1966 within the framework of the specialty 'Thermal energetic' at that time, and since 1973, within the specialty 'Thermal and nuclear energetic'. In 1986 is opened a college on nuclear energetic teaching on specialty 'Nuclear Energetic' and 'Automation in Energetic'. Since 1998 the department 'Thermal and nuclear energetic' is the only one within the Republic of Bulgaria having the legal rights to train 'engineers-bachelors' and 'engineers-master of science' on 'Thermal and nuclear energetic', as well as doctors - engineers of the same specialty. The bachelor course is graduated from between 40 and 60 students annually. The training within the bachelor level is 4 years and finishes by defending diploma thesis. Part of the graduated bachelors (between 20 and 30 students) are closely specialized in the area of Nuclear Energetic. The specialization is trained through preparation of diploma thesis within the nuclear area. The master course has 3 semesters including preparation of diploma thesis. Within the master level are prepared 25 students annually. Within the sub-division 'Nuclear Energetic' are promulgated between 2 and 4 competitions for preparation of doctoral thesis annually. At the moment 7 students are preparing doctoral thesis. Graduated engineers on 'Nuclear Energetic' are engaged as operative personnel mainly in Kozloduy NPP. The rest of them are engaged within the engineering and scientific organizations, connected to nuclear energetic

Large adiabatic temperature change in magnetoelastic transition in Ni{sub 50}Mn{sub 35}Cr{sub 2}Sn{sub 13} Heusler alloy of granular nanostructure

Energy Technology Data Exchange (ETDEWEB)

Prakash, H. R.; Sharma, S. K.; Ram, S., E-mail: prakashhr73@gmail.com [Materials Science Centre, Indian Institute of Technology, Kharagpur-721302 (India); Chatterjee, S. [High Magnetic Field Lab, UGC-DAE Consortium of Scientific Research, Kolkata-700098 (India)

2016-05-06

The Ni-Mn-Sn alloys are a pioneering series of magnetocaloric materials of a huge heat-energy exchanger in the martensite transition. A small additive of nearly 2 at% Cr effectively tunes the valence electron density of 8.090 electrons per atom and a large change in the entropy ΔS{sub M←A} = 4.428 J/kg-K (ΔS{sub M→A} = 3.695 J/kg-K in the recycle) at the martensite ← austenite phase transition as it is useful for the magnetic refrigeration and other cooling devices. The Cr additive tempers the tetragonality with the aspect ratio c/a = 0.903 of the martensite phase and exhibits an adiabatic temperature change of 10 K. At room temperature, a hysteresis loop exhibits 48.91 emu/g saturation magnetization and 82.1 Oe coercivity.

Valence behavior of Eu-ions in intermetallic compound Ce{sub 0.5}Eu{sub 0.5}Pd{sub 3}B{sub 0.5}

Energy Technology Data Exchange (ETDEWEB)

Pandey, Abhishek, E-mail: apandey@ameslab.gov [Experimental Condensed Matter Physics Division, Saha Institute of Nuclear Physics, 1/AF, Bidhannagar, Kolkata 700064 (India); S.N. Bose National Centre for Basic Sciences, Block-JD, Sector-III, Salt Lake, Kolkata 700098 (India); Mazumdar, Chandan, E-mail: chandan.mazumdar@saha.ac.in [S.N. Bose National Centre for Basic Sciences, Block-JD, Sector-III, Salt Lake, Kolkata 700098 (India); Ranganathan, R. [S.N. Bose National Centre for Basic Sciences, Block-JD, Sector-III, Salt Lake, Kolkata 700098 (India); Raghavendra Reddy, V.; Gupta, Ajay [UGC-DAE Consortium for Scientific Research, University Campus, Khandawa Road, Indore (India)

2011-12-15

We have studied the valence behavior of rare-earth ions, in particular Eu-ions, in a cubic intermetallic compound Ce{sub 0.5}Eu{sub 0.5}Pd{sub 3}B{sub 0.5} which is a homogeneous solid solution of two mixed-valent compounds CePd{sub 3} and EuPd{sub 3}B. Results of {sup 151}Eu Moessbauer spectroscopic measurements show that two different valence states, i.e., divalent- and trivalent-like states of Eu-ions exist in the compound. The possible reason for the observed heterogeneous valency vis-a-vis the variation in the chemical environment and the number of nearest-neighbor B atoms surrounding the Eu-ions has been discussed. Our results demonstrate that B incorporation in such Eu-based cubic intermetallic compounds leads to a situation where heterogeneous-valence state of Eu-ions is an energetically favorable ground state. - Highlights: > Intermetallic compound Ce{sub 0.5}Eu{sub 0.5}Pd{sub 3}B{sub 0.5} crystallizes in a single phase. > Eu-ions in Ce{sub 0.5}Eu{sub 0.5}Pd{sub 3}B{sub 0.5} are charge-ordered compared to +2.3 valency in Ce{sub 0.5}Eu{sub 0.5}Pd{sub 3}. > B incorporation makes charge-ordered state of Eu-ions energetically more favorable. > Nearest-neighbor chemical environment affects the Eu valency.

The Immunoreactive Exo-1,3-β-Glucanase from the Pathogenic Oomycete Pythium insidiosum Is Temperature Regulated and Exhibits Glycoside Hydrolase Activity.

Directory of Open Access Journals (Sweden)

Angsana Keeratijarut

Full Text Available The oomycete organism, Pythium insidiosum, is the etiologic agent of the life-threatening infectious disease called "pythiosis". Diagnosis and treatment of pythiosis is difficult and challenging. Novel methods for early diagnosis and effective treatment are urgently needed. Recently, we reported a 74-kDa immunodominant protein of P. insidiosum, which could be a diagnostic target, vaccine candidate, and virulence factor. The protein was identified as a putative exo-1,3-ß-glucanase (Exo1. This study reports on genetic, immunological, and biochemical characteristics of Exo1. The full-length exo1 coding sequence (2,229 bases was cloned. Phylogenetic analysis showed that exo1 is grouped with glucanase-encoding genes of other oomycetes, and is far different from glucanase-encoding genes of fungi. exo1 was up-regulated upon exposure to body temperature, and its gene product is predicted to contain BglC and X8 domains, which are involved in carbohydrate transport, binding, and metabolism. Based on its sequence, Exo1 belongs to the Glycoside Hydrolase family 5 (GH5. Exo1, expressed in E. coli, exhibited ß-glucanase and cellulase activities. Exo1 is a major intracellular immunoreactive protein that can trigger host immune responses during infection. Since GH5 enzyme-encoding genes are not present in human genomes, Exo1 could be a useful target for drug and vaccine development against this pathogen.

Exploring the Υ(6S) → χ{sub bJ}φ and Υ(6S) → χ{sub bJ}ω hidden-bottom hadronic transitions

Energy Technology Data Exchange (ETDEWEB)

Huang, Qi; Wang, Bo; Liu, Xiang [Lanzhou University, School of Physical Science and Technology, Lanzhou (China); Lanzhou University and Institute of Modern Physics of CAS, Research Center for Hadron and CSR Physics, Lanzhou (China); Chen, Dian-Yong [Southeast University, Department of Physics, Nanjing (China); Matsuki, Takayuki [Tokyo Kasei University, Itabashi, Tokyo (Japan); Nishina Center, RIKEN, Theoretical Research Division, Wako, Saitama (Japan)

2017-03-15

In this work, we investigate the hadronic loop contributions to the Υ(6S) → χ{sub bJ}φ (J = 0, 1, 2) along with Υ(6S) → χ{sub bJ}ω (J=0, 1, 2) transitions. We predict that the branching ratios of Υ(6S) → χ{sub b0}φ, Υ(6S) → χ{sub b1}φ and Υ(6S) → χ{sub b2}φ are (0.68-4.62) x 10{sup -6}, (0.50-3.43) x 10{sup -6} and (2.22-15.18) x 10{sup -6}, respectively, and those of Υ(6S) → χ{sub b0}ω, Υ(6S) → χ{sub b1}ω and Υ(6S) → χ{sub b2}ω are (0.15-2.81) x 10{sup -3}, (0.63-11.68) x 10{sup -3}, and (1.08-20.02) x 10{sup -3}, respectively. Especially, some typical ratios, which reflect the relative magnitudes of the predicted branching ratios, are given, i.e., for Υ(6S) → χ{sub bJ}φ transitions, R{sup φ}{sub 10} = B[Υ(6S) → χ{sub b1}φ]/B[Υ(6S) → χ{sub b0}φ] ∼ 0.74, R{sup φ}{sub 20} = B[Υ(6S) → χ{sub b2}φ]/B[Υ(6S) → χ{sub b0}φ] ∼ 3.28, and R{sup φ}{sub 21} = B[Υ(6S) → χ{sub b2}φ]/B[Υ(6S) → χ{sub b1}φ] ∼ 4.43, and for Υ(6S) → χ{sub bJ}ω transitions, R{sup ω}{sub 10} = B[Υ(6S) → χ{sub b1}ω]/B[Υ(6S) → χ{sub b0}ω] ∼ 4.11, R{sup ω}{sub 20} = B[Υ(6S) → χ{sub b2}ω]/B[Υ(6S) → χ{sub b0}ω] ∼ 7.06, and R{sup ω}{sub 21} = B[Υ(6S) → χ{sub b2}ω]/B[Υ(6S) → χ{sub b1}ω] ∼ 1.72. With the running of BelleII in the near future, experimental measurement of these two kinds of transitions will be a potential research issue. (orig.)

Magnesium hexafluoridozirconates MgZrF{sub 6}.5H{sub 2}O, MgZrF{sub 6}.2H{sub 2}O, and MgZrF{sub 6}. Structures, phase transitions, and internal mobility of water molecules

Energy Technology Data Exchange (ETDEWEB)

Gerasimenko, Andrey V.; Gaivoronskaya, Kseniya A.; Slobodyuk, Arseny B.; Didenko, Nina A. [Institute of Chemistry, Russian Academy of Sciences, Vladivostok (Russian Federation)

2017-12-04

The MgZrF{sub 6}.nH{sub 2}O (n = 5, 2 and 0) compounds were studied by the methods of X-ray diffraction and {sup 19}F, MAS {sup 19}F, and {sup 1}H NMR spectroscopy. At room temperature, the compound MgZrF{sub 6}.5H{sub 2}O has a monoclinic C-centered unit cell and is composed of isolated chains of edge-sharing ZrF{sub 8} dodecahedra reinforced with MgF{sub 2}(H{sub 2}O){sub 4} octahedra and uncoordinated H{sub 2}O molecules and characterized by a disordered system of hydrogen bonds. In the temperature range 259 to 255 K, a reversible monoclinic <-> two-domain triclinic phase transition is observed. The phase transition is accompanied with ordering of hydrogen atoms positions and the system of hydrogen bonds. The structure of MgZrF{sub 6}.2H{sub 2}O comprises a three-dimensional framework consisting of chains of edge-sharing ZrF{sub 8} dodecahedra linked to each other through MgF{sub 4}(H{sub 2}O){sub 2} octahedra. The compound MgZrF{sub 6} belongs to the NaSbF{sub 6} type and is built from regular ZrF{sub 6} and MgF{sub 6} octahedra linked into a three-dimensional framework through linear Zr-F-Mg bridges. The peaks in {sup 19}F MAS spectra were attributed to the fluorine structural positions. The motions of structural water molecules were studied by variable-temperature {sup 1}H NMR spectroscopy. (copyright 2017 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

The Science Operations Concept for the ExoMars 2016 Trace Gas Orbiter

Science.gov (United States)

Frew, D.

2014-04-01

The ExoMars 2016 Science Operations Centre (SOC) based at the European Space Astronomy Centre is responsible for coordinating the science planning activities for the Trace Gas Orbiter. Science planning will involve all members of the ExoMars 2016 science ground segment (SGS), namely the SOC at ESAC, the Russian SOC at IKI, the orbiter instrument teams and the science management of the 2016 mission represented by the science working team (SWT) that is chaired by the project scientist. The science operations concept for the mission builds on the legacy inherited from previous ESA planetary missions, in particular from Mars Express for the core plan validation aspects and from the Smart-1 lunar mission for the opportunity analysis and longterm planning approach. Further concept drivers have been derived from the ExoMars 2016 mission profile in the areas of orbit predictability, instrument design and the usage of TGO as a relay for surface assets including the ExoMars 2018 rover. This paper will give an over view of the entire uplink planning process as it is conducted over 3 distinct planning cycles. The Long Term Plan (LTP) establishes the baseline science plan and demonstrates the operational feasibility of meeting the mission science goals formulated by the science working team (SWT) at science management level. The LTP has a planning horizon of 6 months. Each month of the baseline science plan is refined with the instrument teams within the Medium Term Plan (MTP) to converge on a frozen attitude request and resource envelopes for all of the observations in the plan. During the Short Term Planning cycle the SOC will iterate with the teams to finalise the commanding for all of the observations in the plan for the coming week. The description of the uplink planning process will focus on two key areas that are common to all of the planning cycles mentioned above: • Science Plan Abstraction: Interacting with the science plan at the appropriate level of abstraction to

Crystal structure and X-ray photoelectron spectroscopy study of the transition-metal oxides LaFe sub 1 sub - sub x Cr sub x O sub 3

CERN Document Server

Chen Zhi Gang; Yu Jun; Ibrahim, K; Dong Yu Hui; Wu Zi Yu; Wei Long; Wang Yu Tian

2002-01-01

LaFe sub 1 sub - sub x Cr sub x O sub 3 systematic compounds were prepared by Cr sup 3 sup + doping into the end component LaFeO sub 3. The crystal constants have been evaluated by using MarqX code. The analysis of the XRD data confirms that the perovskite compounds are in their single-phase state. The authors have also performed O 1s core-level photoemission experiments using photon energies above and below Fe 2p absorption edge, respectively, in order to investigate the crystal structure variation trend in terms of electronic structure. A preliminary conclusion has been drawn that the charge transfer amount from 0 2p to Cr 3d varies regularly with the doping level of Cr sup 3 sup + in LaFe sub 1 sub - sub x Cr sub x O sub 3

Enhanced ~2.7 µm emission investigation of Er{sup 3+}:{sup 4}I{sub 11/2}→{sup 4}I{sub 13/2} transition in Yb,Er,Pr:SrLaGa{sub 3}O{sub 7} crystal

Energy Technology Data Exchange (ETDEWEB)

Wang, Yan [Key Laboratory of Optoelectronic Materials Chemistry and Physics, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences, Fuzhou, Fujian 350002 (China); Zhang, Baotong [Key Laboratory of Optoelectronic Materials Chemistry and Physics, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences, Fuzhou, Fujian 350002 (China); College of Materials Science and Engineering, Fujian Normal University, Fuzhou, Fujian 350007 (China); Li, Jianfu; Zhu, Zhaojie; You, Zhenyu [Key Laboratory of Optoelectronic Materials Chemistry and Physics, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences, Fuzhou, Fujian 350002 (China); Tu, Chaoyang, E-mail: tcy@fjirsm.ac.cn [Key Laboratory of Optoelectronic Materials Chemistry and Physics, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences, Fuzhou, Fujian 350002 (China)

2017-03-15

The bulk crystal of 5at% Yb{sup 3+}, 20 at% Er{sup 3+} and 0.2 at% Pr{sup 3+} triply doped SrLaGa{sub 3}O{sub 7} (abbr. as Yb,Er,Pr:SLGO) was grown by the Czochralski method. The effects of co-dopant Yb{sup 3+} and Pr{sup 3+} on the spectroscopic properties and the mutual energy transfer mechanism were investigated, via the measurements of its absorption, near-infrared and mid-infrared fluorescence spectra, as well as the fluorescence decay curves of Er{sup 3+}:{sup 4}I{sub 13/2} and {sup 4}I{sub 11/2} levels at room temperature. As compared with 20at% Er{sup 3+} singly doped SrLaGa{sub 3}O{sub 7} crystal, ~2.7 µm emission intensity corresponding to Er{sup 3+}:{sup 4}I{sub 11/2}→{sup 4}I{sub 13/2} transition is enhanced greatly in the Yb,Er,Pr:SLGO crystal. Spectral analyses indicate that the sensitization of Yb{sup 3+} to Er{sup 3+} improves the ~2.7 µm emission in Yb,Er,Pr:SLGO crystal, meanwhile, the depopulation of Pr{sup 3+} from Er{sup 3+} decreases the ~1.5 µm emission and inhibits the self-termination effect. The energy transfer efficiencies of Yb{sup 3+}→Er{sup 3+} (ET1), Er{sup 3+}→Pr{sup 3+} (ET2) and Er{sup 3+}→Pr{sup 3+} (ET3) were estimated and discussed. The above results conclude that Yb,Er,Pr:SLGO crystal is a good candidate for LD pumped mid-infrared laser. - Graphical abstract: As compared with Er: SrLaGa{sub 3}O{sub 7} crystal, ~2.7 µm MIR emissions corresponding to Er{sup 3+}:{sup 4}I{sub 11/2}→{sup 4}I{sub 13/2} transition were enhanced in Yb{sup 3+}, Er{sup 3+} and Pr{sup 3+} triply doped SrLaGa{sub 3}O{sub 7} crystal owing to the sensitization of co-dopant Yb{sup 3+} via ET1, at the same time, ~1.5 µm NIR emissions were weakened owing to the depopulation of co-dopant Pr{sup 3+} via ET3.

Comparative study of low-temperature photoluminescence and thermally stimulated current in quinary Tl{sub 4}Ga{sub 3}InSe{sub 6}S{sub 2} layered crystals

Energy Technology Data Exchange (ETDEWEB)

Gasanly, N.M., E-mail: nizami@metu.edu.tr [Physics Department, Middle East Technical University, 06800 Ankara (Turkey); Virtual International Scientific Research Centre, Baku State University, 1148 Baku (Azerbaijan)

2016-04-15

Photoluminescence (PL) and thermally stimulated current (TSC) spectra of Tl{sub 4}Ga{sub 3}InSe{sub 6}S{sub 2} layered crystals grown by Bridgman method have been studied in the wavelength region of 560–690 nm and the temperature range of 15–45 K (PL) and in the temperature region of 10–90 K (TSC). A broad PL band centered at 620 nm (2.00 eV) was observed at T=15 K. Variations of emission band has been studied as a function of excitation laser intensity in the 0.7–36.5 mW cm{sup −2} range. Radiative transitions from donor level located at 150 meV below the bottom of conduction band to shallow acceptor level located at 10 meV above the top of the valence band were suggested to be responsible for the observed PL band. TSC curve of Tl{sub 4}Ga{sub 3}InSe{sub 6}S{sub 2} crystal exhibited one broad peak at about 41 K. The activation energy of trap level was found to be 11 meV. An energy level diagram showing transitions in the band gap of the crystal was plotted taking into account the results of PL and TSC measurements carried out below room temperature.

ENERGETIC FERMI/LAT GRB 100414A: ENERGETIC AND CORRELATIONS

Energy Technology Data Exchange (ETDEWEB)

Urata, Yuji; Tsai, Patrick P. [Institute of Astronomy, National Central University, Chung-Li 32054, Taiwan (China); Huang, Kuiyun [Academia Sinica Institute of Astronomy and Astrophysics, Taipei 106, Taiwan (China); Yamaoka, Kazutaka [Department of Physics and Mathematics, Aoyama Gakuin University, 5-10-1, Fuchinobe, Sayamihara 229-8558 (Japan); Tashiro, Makoto S., E-mail: urata@astro.ncu.edu.tw [Department of Physics, Saitama University, Shimo-Okubo, Saitama 338-8570 (Japan)

2012-03-20

This study presents multi-wavelength observational results for energetic GRB 100414A with GeV photons. The prompt spectral fitting using Suzaku/WAM data yielded spectral peak energies of E{sup src}{sub peak} of 1458.7{sup +132.6}{sub -106.6} keV and E{sub iso} of 34.5{sup +2.0}{sub -1.8} Multiplication-Sign 10{sup 52} erg with z = 1.368. The optical afterglow light curves between 3 and 7 days were effectively fitted according to a simple power law with a temporal index of {alpha} = -2.6 {+-} 0.1. The joint light curve with earlier Swift/UVOT observations yields a temporal break at 2.3 {+-} 0.2 days. This was the first Fermi/LAT detected event that demonstrated the clear temporal break in the optical afterglow. The jet opening angle derived from this temporal break was 5.{sup 0}8, consistent with those of other well-observed long gamma-ray bursts (GRBs). The multi-wavelength analyses in this study showed that GRB 100414A follows E{sup src}{sub peak}-E{sub iso} and E{sup src}{sub peak}-E{sub {gamma}} correlations. The late afterglow revealed a flatter evolution with significant excesses at 27.2 days. The most straightforward explanation for the excess is that GRB 100414A was accompanied by a contemporaneous supernova. The model light curve based on other GRB-SN events is marginally consistent with that of the observed light curve.

A Computational Experiment of the Endo versus Exo Preference in a Diels-Alder Reaction

Science.gov (United States)

Rowley, Christopher N.; Woo, Tom K.

2009-01-01

We have developed and tested a computational laboratory that investigates an endo versus exo Diels-Alder cycloaddition. This laboratory employed density functional theory (DFT) calculations to study the cycloaddition of N-phenylmaleimide to furan. The endo and exo stereoisomers of the product were distinguished by building the two isomers in a…

Effect of excess Ni on martensitic transition, exchange bias and inverse magnetocaloric effect in Ni{sub 2+x}Mn{sub 1.4−x}Sn{sub 0.6} alloy

Energy Technology Data Exchange (ETDEWEB)

Ray, Mayukh K., E-mail: mayukh.ray@saha.ac.in; Bagani, K.; Banerjee, S., E-mail: sangam.banerjee@saha.ac.in

2014-07-05

Highlights: • Excess Ni causes an increase in the martensite transition temperature. • The system Ni{sub 2+x}Mn{sub 1.4−x}Sn{sub 0.6} exhibit multifunctional properties. • The RCP and EB increases continuously with excess Ni concentration in the system. • Antiferromagnetic interaction increases with excess Ni concentration. - Abstract: The martensitic transition, exchange bias (EB) and inverse magnetocaloric effect (IMCE) of bulk Ni{sub 2+x}Mn{sub 1.4−x}Sn{sub 0.6} (x = 0, 0.06, 0.12, 0.18) Heusler alloy is investigated in this paper. Substitution of Mn by Ni causes an increase in the martensite transition temperature (T{sub M}), decrease in Curie temperature of austenite phase (T{sub C}{sup A}) and also a decrease in the saturation magnetic moment (M{sub sat}). While the decrease in T{sub C}{sup A} and M{sub sat} is explained by the dilution of the magnetic subsystems and on the other hand the increase in T{sub M} is due to the increase of valence electron concentration per atom (e/a). All the alloys shows EB effect below a certain temperature (T{sup ∗}) and EB field (H{sub EB}) value is almost thrice in magnitude for x = 0.18 sample compared to x = 0 sample at 5 K. In these alloys, Ni/Mn atoms at regular site couples antiferromagnetically (AFM) with the excess Ni atoms at Mn or Sn sites and this AFM coupling plays the key role in the observation of EB. For the IMCE, the change in magnetic entropy (ΔS{sub M}) initially increased with excess Ni concentration upto x = 0.12 but then a drastic fall in ΔS{sub M} value is observed for the sample x = 0.18 but the relative cooling power (RCP) value is increased continuously with the excess Ni concentration.

VizieR Online Data Catalog: ExoMol line lists for 28SiH4

Science.gov (United States)

Owens, A.; Yachmenev, A.; Thiel, W.; Tennyson, J.; Yurchenko, S. N.

2017-08-01

The states file sih4_e42.dat contains a list of rovibrational states. Each state is labelled with: nine TROVE local mode vibrational quantum numbers and the vibrational symmetry; three rotational quantum numbers including the total angular momentum J and rotational symmetry; the total symmetry quantum number Gamma. In addition there is a largest coefficients used to assign the state in question. Each rovibrational state has a unique number, which is the number of the row in which it appears in the file. This number is the means by which the state is related to the second part of the data system, the transitions files. The total degeneracy is also given to facilitate the intensity calculations. Because of their size, the transitions are listed in 50 separate files, each containing all the transitions in a 100cm-1 frequency range. These transition files T_*.dat contain the silane lines lines consisting of three columns: the reference number in the energy file of the upper state, that of the lower state, the Einstein A coefficient of the transition and the transition wavenumber. These entries are ordered by increasing frequency. The name of the file includes the lowest frequency in the range; thus the T_00500.dat file contains all the transitions in the frequency range 500-600cm-1. The energy file and the transitions files are bzipped, and need to be extracted before use. A programme ExoCross to generate synthetic spectra from these line lists can be obtained at www.exomol.com. (2 data files).

Shape-dependent Surface Energetics of Nanocrystalline TiO2

Energy Technology Data Exchange (ETDEWEB)

Park, T.J.; Wong, S.; Levchenko, A.A.; Zhou, H.; Navrotsky, A.

2010-10-21

We report the direct determination of surface enthalpies for nanophase TiO{sub 2} anatase with different morphologies derived from drop solution calorimetry in a molten sodium molybdate (3Na{sub 2}Ol{center_dot}4MoO{sub 3}) solvent at 702 C. The energetics of surface hydration has been measured using a Calvet microcalorimeter coupled with a gas dosing system. The surface enthalpies of hydrated surfaces for anatase TiO{sub 2} nanoparticles, nanowires and sea-urchin-like assemblies are 0.51 {+-} 0.05, 1.07 {+-} 0.28, and 1.29 {+-} 0.16 J m{sup -2}, respectively, whereas those of anhydrous surfaces are 0.74 {+-} 0.04, 1.24 {+-} 0.28, and 1.41 {+-} 0.16 J m{sup -2}, respectively. The trend in TiO{sub 2}, which shows higher surface enthalpies for more complex nanostructures, is consistent with that reported in ZnO. The shape-dependent surface enthalpy at the nanoscale level is discussed in terms of exposed surface structures. The enthalpies of hydration appear to be similar for all morphologies.

System Geometries and Transit/Eclipse Probabilities

Directory of Open Access Journals (Sweden)

Howard A.

2011-02-01

Full Text Available Transiting exoplanets provide access to data to study the mass-radius relation and internal structure of extrasolar planets. Long-period transiting planets allow insight into planetary environments similar to the Solar System where, in contrast to hot Jupiters, planets are not constantly exposed to the intense radiation of their parent stars. Observations of secondary eclipses additionally permit studies of exoplanet temperatures and large-scale exo-atmospheric properties. We show how transit and eclipse probabilities are related to planet-star system geometries, particularly for long-period, eccentric orbits. The resulting target selection and observational strategies represent the principal ingredients of our photometric survey of known radial-velocity planets with the aim of detecting transit signatures (TERMS.

First observation of the strongly forbidden transition {sup 1}S{sub 0} - {sup 3}P{sub 0} in Strontium, for an atomic clock with trapped atoms; Premiere observation de la transition fortement interdite {sup 1}S{sub 0} - {sup 3}P{sub 0} du strontium, pour une horloge optique a atomes pieges

Energy Technology Data Exchange (ETDEWEB)

Courtillot, I

2003-11-01

This thesis reports the first results towards the realization of an optical clock using trapped strontium atoms. This set up would combine advantages of the different approaches commonly used to develop an atomic frequency standard. The first part describes the cold atoms source which is implemented. A magneto-optical trap operating on the {sup 1}S{sub 0}-{sup 1}P{sub 1} transition at 461 nm is loaded from an atomic beam decelerated by a Zeeman slower. The 461 nm laser is obtained by sum-frequency mixing in a potassium titanyl phosphate (KTP) crystal. The second part is devoted to the different stages developed to achieve the direct excitation of the {sup 1}S{sub 0}-{sup 3}P{sub 0} clock transition in {sup 87}Sr. This line has a theoretical natural width of 10{sup -3} Hz. Before this detection, we obtained an estimate of the resonance frequency by measuring absolute frequencies of several allowed optical transitions. (author)

Exo-metabolome of some fungal isolates growing on cork-based medium

DEFF Research Database (Denmark)

Barreto, M. C.; Frisvad, Jens Christian; Larsen, Thomas Ostenfeld

2011-01-01

are produced by the studied fungal species, both in cork medium or in cork medium added with C. sitophila extracts. However, the addition of C. sitophila extract to the cork medium enhanced the growth of the other studied fungal isolates and altered the respective exo-metabolome profile, leading...... they can be dependent of the remains of former colonizers. In fact, the production of the exo-metabolites by the studied fungal isolates suggests that, under the used experimental conditions, they appear to play an important role in fungal interactions amongst the cork mycoflora....

Properties and origin of energetic particles at the duskside of the Earth's magnetosheath throughout a great storm

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D. V. Sarafopoulos

Full Text Available We study an interval of 56 h on January 16 to 18, 1995, during which the GEOTAIL spacecraft traversed the duskside magnetosheath from 
X @ -15 to -40 R<sub>E> and the EPIC/ICS and EPIC/STICS sensors sporadically detected tens of energetic particle bursts. This interval coincides with the expansion and growth of a great geomagnetic storm. The flux bursts are strongly dependent on the magnetic field orientation. They switch on whenever the B<sub>z> component approaches zero (B<sub>z> @ 0 nT. We strongly suggest a magnetospheric origin for the energetic ions and electrons streaming along these "exodus channels". The time profiles for energetic protons and "tracer" O⁺ ions are nearly identical, which suggests a common source. We suggest that the particles leak out of the magnetosphere all the time and that when the magnetosheath magnetic field connects the spacecraft to the magnetotail, they stream away to be observed by the GEOTAIL sensors. The energetic electron fluxes are not observed as commonly as the ions, indicating that their source is more limited in extent. In one case study the magnetosheath magnetic field lines are draped around the magnetopause within the YZ plane and a dispersed structure for peak fluxes of different species is detected and interpreted as evidence for energetic electrons leaking out from the dawn LLBL and then being channelled along the draped magnetic field lines over the magnetopause. Protons leak from the equatorial dusk LLBL and this spatial differentiation between electron and proton sources results in the observed dispersion. A gradient of energetic proton intensities toward the Z<sub>GSM> = 0 plane is inferred. There is a permanent layer of energetic particles adjacent to the magnetosheath during this interval in which the dominant component of the magnetic field was B<sub>z