Thermal properties of GdSr{sub 2}RuCu{sub 2}O{sub 8-{delta}} based mixtures in the GdSr{sub 2}RuO{sub 6}-CuO pseudo-binary system

Energy Technology Data Exchange (ETDEWEB)

Gombos, Marcello [Laboratorio Regionale Supermat CNR-INFM Via Salvador Allende, I-84081 Baronissi (Italy); Dipartimento di Fisica ' E.R.Caianiello' , Universita di Salerno, Via Salvador Allende, I-84081 Baronissi (Italy)], E-mail: gombos@sa.infn.it; Ciancio, Regina; Vecchione, Antonio; Pace, Sandro [Laboratorio Regionale Supermat CNR-INFM Via Salvador Allende, I-84081 Baronissi (Italy); Dipartimento di Fisica ' E.R.Caianiello' , Universita di Salerno, Via Salvador Allende, I-84081 Baronissi (Italy)

2007-09-01

GdSr{sub 2}RuCu{sub 2}O{sub 8-{delta}} (Gd1212) rutheno-cuprate compound is widely studied because it shows the coexistence of superconductivity and highly anisotropic magnetic ordering in the same cell. Anyway the nature of the magnetic ordering is still debated and the fabrication of macroscopic samples oriented along a crystallographic axis, that could help to clarify its details, appears to be quite difficult. For this reason, accurate investigation on Gd1212 incongruent melting reaction, producing liquid copper oxide and the solid GdSr{sub 2}RuO{sub 6} (Gd1210), appears to be necessary to improve the fabrication of crystallographically oriented bulk superconducting samples. Thermo-gravimetric and differential thermal measurements were performed to analyse the thermal behaviour up to 1200 deg. C and the melting temperatures of different mixtures of Gd1212 with Gd1210 or CuO, in view to perform a scan of the whole CuO-Gd1212-Gd1210 coexistence line of the Gd-Sr-Ru-Cu-O phase diagram. Dependence on the atmosphere and the formation of different spurious phases was also studied.

Effect of B-site cation stoichiometry on electrical fatigue of RuO2//Pb(ZrxTi1-x)O3//RuO2 capacitors

International Nuclear Information System (INIS)

Al-Shareef, H.N.; Tuttle, B.A.; Warren, W.L.; Headley, T.J.; Dimos, D.; Voigt, J.A.; Nasby, R.D.

1996-01-01

There have been numerous reports that Pb(Zr x Ti 1-x )O 3 (PZT) thin-film capacitors with RuO 2 electrodes and compositions near the morphotropic phase boundary exhibit minimal decrease in switched polarization with electric-field cycling. We show that the fatigue performance of RuO 2 //PZT//RuO 2 capacitors strongly depends on PZT film composition. Specifically, we demonstrate that the rate of polarization fatigue increases with increasing Ti content for PZT thin films of tetragonal crystal symmetry deposited on RuO 2 electrodes. As the Ti content of the PZT films increased, the film gain morphology changed from columnar to granular and the volume percent of a fluorite-type second phase decreased. These microstructural trends and the possibility that the electrode material acts as a sink for oxygen vacancies are discussed to explain the fatigue dependence on B-site cation ratio for PZT films with RuO 2 electrodes. copyright 1996 American Institute of Physics

Preparation of RuO2-TiO2/Nano-graphite composite anode for electrochemical degradation of ceftriaxone sodium.

Science.gov (United States)

Li, Dong; Guo, Xiaolei; Song, Haoran; Sun, Tianyi; Wan, Jiafeng

2018-06-05

Graphite-like material is widely used for preparing various electrodes for wastewater treatment. To enhance the electrochemical degradation efficiency of Nano-graphite (Nano-G) anode, RuO 2 -TiO 2 /Nano-G composite anode was prepared through the sol-gel method and hot-press technology. RuO 2 -TiO 2 /Nano-G composite was characterized by X-ray diffraction, X-ray photoelectron spectroscopy, transmission electron microscopy and N 2 adsorption-desorption. Results showed that RuO 2 , TiO 2 and Nano-G were composited successfully, and RuO 2 and TiO 2 nanoparticles were distributed uniformly on the surface of Nano-G sheet. Specific surface area of RuO 2 -TiO 2 /Nano-G composite was higher than that of TiO 2 /Nano-G composite and Nano-G. Electrochemical performances of RuO 2 -TiO 2 /Nano-G anode were investigated by cyclic voltammetry, electrochemical impedance spectroscopy. RuO 2 -TiO 2 /Nano-G anode was applied to electrochemical degradation of ceftriaxone. The generation of hydroxyl radical (OH) was measured. Results demonstrated that RuO 2 -TiO 2 /Nano-G anode displayed enhanced electrochemical degradation efficiency towards ceftriaxone and yield of OH, which is derived from the synergetic effect between RuO 2 , TiO 2 and Nano-G, which enhance the specific surface area, improve the electrochemical oxidation activity and lower the charge transfer resistance. Besides, the possible degradation intermediates and pathways of ceftriaxone sodium were identified. This study may provide a viable and promising prospect for RuO 2 -TiO 2 /Nano-G anode towards effective electrochemical degradation of antibiotics from wastewater. Copyright © 2018 Elsevier B.V. All rights reserved.

Modulation of transport properties of RuO2 with 3d transition metals

International Nuclear Information System (INIS)

Music, Denis; Chen, Yen-Ting; Geyer, Richard W; Bliem, Pascal; Schneider, Jochen M

2014-01-01

Using density functional theory, we have demonstrated that alloying of RuO 2 (P4 2 /mnm) with 3d transition metals (Sc, Ti, V, Cr, Mn, Fe, Co, Ni, Cu, Zn) gives rise to a substantial increase in the Seebeck coefficient probably due to quantum confinement. As Fe yields the largest enhancement, it was selected for experimental verification. We synthesized combinatorial Ru–Fe–O thin films and subsequently measured their transport properties at elevated temperatures. The Fe-alloyed samples increase the Seebeck coefficient threefold with respect to the unalloyed RuO 2 specimen thereby verifying the theoretical prediction. The here obtained power factor of 274 μW K −2 m −1 is not only the largest reported value for RuO 2 based compounds but it also occurs at ∼600 °C thus increasing the Carnot efficiency significantly. (paper)

Supercapacitive performance of hydrous ruthenium oxide (RuO2 ...

Indian Academy of Sciences (India)

2016-08-26

SO4 electrolyte. RuO2.H2O film showed maximum specific capacitance of 192 F.g-1 at a scan rate of 20 mV.s-1. The charge–discharge studies of RuO2.H2O carried out at 300 A.cm-2 current density revealed the specific ...

Synergistic effects for the TiO2/RuO2/Pt photodissociation of water

Energy Technology Data Exchange (ETDEWEB)

Blondel, G; Harriman, A; Williams, D

1983-07-01

Compressed discs of naked TiO2 or TiO2 coated with a thin film of a noble metal (e.g. Pt) do not photodissociate water upon illumination with UV light, but small amounts of H2 are generated if the TiO2 has been reduced in a stream of H2 at 600 C. Discs prepared from mixtures of TiO2/RuO2 facilitate the UV photodissociation of water into H2 and O2 although the yields are very low. When a thin (about 9 nm) film of Pt is applied to the TiO2/RuO2 discs, the yields of H2 and O2 observed upon irradiation with UV light are improved drastically. 25 references.

Characteristics of RuO{sub 2}-SnO{sub 2} nanocrystalline-embedded amorphous electrode for thin film microsupercapacitors

Energy Technology Data Exchange (ETDEWEB)

Kim, Han-Ki [Core Technology Laboratory, Samsung SDI, 575 Shin-dong, Youngtong-Gu, Suwon, Gyeonggi-Do 442-391 (Korea, Republic of)]. E-mail: hanki1031.kim@samsung.com; Choi, Sun-Hee [Nano Materials Research Center, Korea Institute of Science and Technology (KIST), PO Box 131 Choengryang, Seoul 130-650 (Korea, Republic of); Yoon, Young Soo [Department of Advanced Fusion Technology (DAFT), Konkuk University, 1 Hwayang-dong, Gwangjin-gu, Seoul 143-701 (Korea, Republic of); Chang, Sung-Yong [Department of Materials Science and Engineering, Gwangju Institute of Science and Technology (GIST), Kwangju 500-712 (Korea, Republic of); Ok, Young-Woo [Department of Materials Science and Engineering, Gwangju Institute of Science and Technology (GIST), Kwangju 500-712 (Korea, Republic of); Seong, Tae-Yeon [Department of Materials Science and Engineering, Gwangju Institute of Science and Technology (GIST), Kwangju 500-712 (Korea, Republic of)

2005-03-22

The characteristics of RuO{sub 2}-SnO{sub 2} nanocrystalline-embedded amorphous electrode, grown by DC reactive sputtering, was investigated. X-ray diffraction (XRD), transmission electron microscopy (TEM), and transmission electron diffraction (TED) examination results showed that Sn and Ru metal cosputtered electrode in O{sub 2}/Ar ambient have RuO{sub 2}-SnO{sub 2} nanocrystallines in an amorphous oxide matrix. It is shown that the cyclic voltammorgram (CV) result of the RuO{sub 2}-SnO{sub 2} nanocrystalline-embedded amorphous film in 0.5 M H{sub 2}SO{sub 4} liquid electrolyte is similar to a bulk-type supercapacitor behavior with a specific capacitance of 62.2 mF/cm{sup 2} {mu}m. This suggests that the RuO{sub 2}-SnO{sub 2} nanocrystalline-embedded amorphous film can be employed in hybrid all-solid state energy storage devises as an electrode of supercapacitor.

An unprecedented up-field shift in the 13C NMR spectrum of the carboxyl carbons of the lantern-type dinuclear complex TBA[Ru2(O2CCH3)4Cl2] (TBA+ = tetra(n-butyl)ammonium cation).

Science.gov (United States)

Hiraoka, Yuya; Ikeue, Takahisa; Sakiyama, Hiroshi; Guégan, Frédéric; Luneau, Dominique; Gillon, Béatrice; Hiromitsu, Ichiro; Yoshioka, Daisuke; Mikuriya, Masahiro; Kataoka, Yusuke; Handa, Makoto

2015-08-14

A large up-field shift (-763 ppm) has been observed for the carboxyl carbons of the dichlorido complex TBA[Ru(2)(O(2)CCH(3))(4)Cl(2)] (TBA(+) = tetra(n-butyl)ammonium cation) in the (13)C NMR spectrum (CD(2)Cl(2) at 25 °C). The DFT calculations showed spin delocalization from the paramagnetic Ru(2)(5+) core to the ligands, in agreement with the large up-field shift.

Preparation and characterization of RuO2/polypyrrole electrodes for supercapacitors

Science.gov (United States)

Li, Xiang; Wu, Yujiao; Zheng, Feng; Ling, Min; Lu, Fanghai

2014-11-01

Polypyrrole (PPy) embedded RuO2 electrodes were prepared by the composite method. Precursor solution of RuO2 was coated on tantalum sheet and annealed at 260 °C for 2.5 h to develop a thin film. PPy particles were deposited on RuO2 films and dried at 80 °C for 12 h to form composite electrode. Microstructure and morphology of RuO2/PPy electrode were characterized using Fourier transform infrared spectrometer, X-ray diffraction and scanning electron microscopy, respectively. Our results confirmed that counter ions are incorporated into RuO2 matrix. Structure of the composite with amorphous phase was verified by X-ray diffraction. Analysis by scanning electron microscopy reveals that during grain growth of RuO2/PPy, PPy particle size sharply increases as deposition time is over 20 min. Electrochemical properties of RuO2/PPy electrode were calculated using cyclic voltammetry. As deposition times of PPy are 10, 20, 25 and 30 min, specific capacitances of composite electrodes reach 657, 553, 471 and 396 F g-1, respectively. Cyclic behaviors of RuO2/PPy composite electrodes are stable.

Atomistic growth phenomena of reactively sputtered RuO{sub 2} and MnO{sub 2} thin films

Energy Technology Data Exchange (ETDEWEB)

Music, Denis, E-mail: music@mch.rwth-aachen.de; Bliem, Pascal; Geyer, Richard W.; Schneider, Jochen M. [Materials Chemistry, RWTH Aachen University, Kopernikusstr. 10, 52074 Aachen (Germany)

2015-07-07

We have synthesized RuO{sub 2} and MnO{sub 2} thin films under identical growth conditions using reactive DC sputtering. Strikingly different morphologies, namely, the formation of RuO{sub 2} nanorods and faceted, nanocrystalline MnO{sub 2}, are observed. To identify the underlying mechanisms, we have carried out density functional theory based molecular dynamics simulations of the growth of one monolayer. Ru and O{sub 2} molecules are preferentially adsorbed at their respective RuO{sub 2} ideal surface sites. This is consistent with the close to defect free growth observed experimentally. In contrast, Mn penetrates the MnO{sub 2} surface reaching the third subsurface layer and remains at this deep interstitial site 3.10 Å below the pristine surface, resulting in atomic scale decomposition of MnO{sub 2}. Due to this atomic scale decomposition, MnO{sub 2} may have to be renucleated during growth, which is consistent with experiments.

RuO 2 nanoparticles supported on MnO 2 nanorods as high efficient bifunctional electrocatalyst of lithium-oxygen battery

Energy Technology Data Exchange (ETDEWEB)

Xu, Yue-Feng; Chen, Yuan; Xu, Gui-Liang; Zhang, Xiao-Ru; Chen, Zonghai; Li, Jun-Tao; Huang, Ling; Amine, Khalil; Sun, Shi-Gang

2016-10-01

RuO2 nanoparticles supported on MnO2 nanorods (denoted as np-RuO2/nr-MnO2) were synthesized via a two-step hydrothermal reaction. SEM and TEM images both illustrated that RuO2 nanoparticles are well dispersed on the surface of MnO2 nanorods in the as-prepared np-RuO2/nr-MnO2 material. Electrochemical results demonstrated that the np-RuO2/nr-MnO2 as oxygen cathode of Li-O-2 batteries could maintain a reversible capacity of 500 mA h g(-1) within 75 cycles at a rate of 50 mA g(-1), and a higher capacity of 4000 mA h g(-1) within 20 cycles at a rate as high as 200 mA g(-1). Moreover, the cell with the np-RuO2/nr-MnO2 catalyst presented much lower voltage polarization (about 0.58 V at a rate of 50 mA g(-1)) than that measured with only MnO2 nanorods during charge/discharge processes. The catalytic property of the np-RuO2/nr-MnO2 and MnO2 nanorods were further compared by conducting studies of using rotating disk electrode (RDE), chronoamperommetry and linear sweep voltammetry. The results illustrated that the np-RuO2/nr-MnO2 exhibited excellent bifunctional electrocatalytic activities towards both oxygen reduction reaction (ORR) and oxygen evolution reaction (OER). Furthermore, in-situ high-energy X-ray diffraction was employed to trace evolution of species on the np-RuO2/nr-MnO2 cathode during the discharge processes. In-situ XRD patterns demonstrated the formation process of the discharge products that consisted of mainly Li2O2. Ex-situ SEM images were recorded to investigate the morphology and decomposition of the sphere-like Li2O2, which could be observed clearly after discharge process, while are decomposed almost after charge process. The excellent electrochemical performances of the np-RuO2/nr-MnO2 as cathode of Li-O-2 battery could be contributed to the excellent bifunctional electrocatalytic activities for both the ORR and OER, and to the one-dimensional structure which would benefit the diffusion of oxygen and the storage of Li2O2 in the discharge process of

The orthorhombic fluorite related compounds Ln/sub 3/RuO/sub 7/, Ln=Nd, Sm and Eu

International Nuclear Information System (INIS)

Van Berkel, F.P.F.; Ijdo, D.J.W.

1986-01-01

Fluorite-related Ru(V) compound with composition Ln/sub 3/RuO/sub 7/ have been found. These compounds with space group Cmcm adopt a superstructure of the cubic fluorite structure with a/sub orth/=2a/sub c/, b/sub orth/=c/sub orth/=a/sub c/√2. These compounds have the same structure as La/sub 3/NbO/sub 7/

Ambipolar thermoelectric power of chemically-exfoliated RuO2 nanosheets

Science.gov (United States)

Kim, Jeongmin; Yoo, Somi; Moon, Hongjae; Kim, Se Yun; Ko, Dong-Su; Roh, Jong Wook; Lee, Wooyoung

2018-01-01

The electrical conductivity and Seebeck coefficient of RuO2 nanosheets are enhanced by metal nanoparticle doping using Ag-acetate solutions. In this study, RuO2 monolayer and bilayer nanosheets exfoliated from layered alkali metal ruthenates are transferred to Si substrates for device fabrication, and the temperature dependence of their conductivity and Seebeck coefficients is investigated. For pristine RuO2 nanosheets, the sign of the Seebeck coefficient changes with temperature from 350-450 K. This indicates that the dominant type of charge carrier is dependent on the temperature, and the RuO2 nanosheets show ambipolar carrier transport behavior. By contrast, the sign of the Seebeck coefficient for Ag nanoparticle-doped RuO2 nanosheets does not change with temperature, indicating that the extra charge carriers from metal nanoparticles promote n-type semiconductor behavior.

A Renewable and Ultrasensitive Electrochemiluminescence Immunosenor Based on Magnetic RuL@SiO2-Au~RuL-Ab2 Sandwich-Type Nano-Immunocomplexes

Directory of Open Access Journals (Sweden)

Ning Gan

2011-08-01

Full Text Available An ultrasensitive and renewable electrochemiluminescence (ECL immunosensor was developed for the detection of tumor markers by combining a newly designed trace tag and streptavidin-coated magnetic particles (SCMPs. The trace tag (RuL@SiO2-Au~RuL-Ab2 was prepared by loading Ru(bpy32+(RuL-conjuged secondary antibodies (RuL-Ab2 on RuL@SiO2 (RuL-doped SiO2 doped Au (RuL@SiO2-Au. To fabricate the immunosensor, SCMPs were mixed with biotinylated AFP primary antibody (Biotin-Ab1, AFP, and RuL@SiO2-Au~RuL-Ab2 complexes, then the resulting SCMP/Biotin-Ab1/AFP/RuL@SiO2-Au~RuL-Ab2 (SBAR sandwich-type immunocomplexes were absorbed on screen printed carbon electrode (SPCE for detection. The immunocomplexes can be easily washed away from the surface of the SPCE when the magnetic field was removed, which made the immunosensor reusable. The present immunosensor showed a wide linear range of 0.05–100 ng mL–1 for detecting AFP, with a low detection limit of 0.02 ng mL–1 (defined as S/N = 3. The method takes advantage of three properties of the immunosensor: firstly, the RuL@SiO2-Au~RuL-Ab2 composite exhibited dual amplification since SiO2 could load large amount of reporter molecules (RuL for signal amplification. Gold particles could provide a large active surface to load more reporter molecules (RuL-Ab2. Accordingly, through the ECL response of RuL and tripropylamine (TPA, a strong ECL signal was obtained and an amplification analysis of protein interaction was achieved. Secondly, the sensor is renewable because the sandwich-type immunocomplexes can be readily absorbed or removed on the SPCE’s surface in a magnetic field. Thirdly, the SCMP modified probes can perform the rapid separation and purification of signal antibodies in a magnetic field. Thus, the present immunosensor can simultaneously realize separation, enrichment and determination. It showed potential application for the detection of AFP in human sera.

Synthesis and thermoelectric properties of RuO2 nanorods

International Nuclear Information System (INIS)

Music, Denis; Basse, Felix H.-U.; Schneider, Jochen M.; Hassdorf, Ralf

2010-01-01

We have explored the effect of the O/Ru ratio on the morphology and the Seebeck coefficient of RuO 2 nanorods (space group P4 2 /mnm) synthesized by reactive sputtering. At an O/Ru ratio of 1.69, a faceted surface is observed, while nanorod formation occurs at O/Ru ratios of 2.03 and 2.24. Using classical molecular dynamics with the potential parameters derived in this work, we show that volatile species enable nanorod formation. Based on ab initio calculations, two effects of the nanorod formation on the Seebeck coefficient are observed: (i) increase due to additional states in the vicinity of the Fermi level and (ii) decrease due to oxygen point defects (volatile species). These two competing effects give rise to a moderate increase in the Seebeck coefficient upon nanorod formation.

Supraconductivity of TR-Ru3Si2 compounds (TR = La, Ce)

International Nuclear Information System (INIS)

Godart, C.; Gupta, L.C.; Parks, R.D.; Rauschwalbe, U.; Alheim, U.; Gottwick, U.; Lieke, W.; Steglich, F.

1984-01-01

A new family of superconducting ternary silicides MRu 3 Si 2 with M = La (Tsub(s) approximately 7 K), Y and Th was discovered by Barz and Vandenberg. Same compounds with M from Nd to Tm are magnetic and not superconductors. We studied superconductivity in the solid solution Cesub(1-x)Lasub(x)Ru 3 Si 2 of hexagonal structure from x = 0 to 1. CeRu 3 Si 2 is type II superconductor (Tsub(s) approximately 1 K), like LaRu 3 Si 2 , and is mixed valent (M.V.). Spin fluctuations temperature (Tsub(sf) approximately 440 K) is between these of non superconducting M.V. like CeSn 3 (Tsub(sf) approximately 270) and these of superconducting M.V. like CeRu 2 (Tsub(sf) approximately 770 K). Cesub(1-x)Lasub(x)Ru 3 Si 2 is the first M.V. system of Ce which is superconductor from x = 0 to 1 [fr

The electrocatalytic application of RuO2 in direct borohydride fuel cells

International Nuclear Information System (INIS)

Yang, Xiaodong; Wei, Xiaozhu; Liu, Ce; Liu, Yongning

2014-01-01

A high electrocatalytic activity of RuO 2 has been found for oxygen reduction reaction (ORR) in the cathode of direct borohydride fuel cells (DBFCs). The electron transfer number n during the ORR changes from 3.58 to 3.86 and the percentage of the intermediate product H 2 O 2 decreases from 20.8% to 7.2% correspondingly when the disk potential scans negatively from −0.39 V to −0.8 V versus Hg/HgO. Peak power densities of 425 mW cm −2 has been obtained at 60 °C, when RuO 2 has been used as a cathodic catalyst in DBFCs. RuO 2 displays low sensitivity to the BH 4 − oxidation in DBFCs. Moreover, RuO 2 , as a cathodic catalyst, demonstrates a superb stability during a 200-h durability test. The identical X-ray diffraction (XRD) patterns of the RuO 2 before and after the durability test also prove its stability. - Highlights: • RuO 2 exhibits oxygen reduction reaction (ORR) activity in an alkaline solution. • RuO 2 provides 3.58–3.86 electron transfer number during the ORR. • Direct borohydride fuel cell (DBFC) with RuO 2 cathode displays a peak power density of 425 mW cm −2 at 60 °C. • DBFC with RuO 2 cathode exhibits a superb stability during a 200-h durability test

Photocrystallographic structure determination of a new geometric isomer of [Ru(NH3)4(H2O)(eta1-OSO)][MeC6H4SO3]2.

Science.gov (United States)

Bowes, Katharine F; Cole, Jacqueline M; Husheer, Shamus L G; Raithby, Paul R; Savarese, Teresa L; Sparkes, Hazel A; Teat, Simon J; Warren, John E

2006-06-21

The structure of a new metastable geometric isomer of [Ru(NH3)4(H2O)(SO2)][MeC6H4SO3]2 in which the SO2 group is coordinated through a single oxygen in an eta1-OSO bonding mode has been determined at 13 K; the new isomer was obtained as a 36% component of the structure within a single crystal upon irradiation using a tungsten lamp.

Assessment for the role of rare earth oxide in the R2O3 - RuO2 - Pt composite electrode

International Nuclear Information System (INIS)

Do Ngoc Lien; Nguyen Van Sinh

2004-01-01

Our work has showed several results related to assessment for the role of rare earth oxide in the R 2 O 3 - RuO 2 - Pt composite electrode. The precursor method was used for preparing composite electrode in the following forms: a- RuO 2 - Pt electrode b- La 2 O 3 (55%) - RuO 2 (45%) - Pt electrode c- CeO 2 (60%) - RuO 2 (40%) - Pt electrode By measurements of anodic polarization and cyclic potential for the types of a, b, c electrodes we can see that the La 2 O 3 (55%) - 45% RuO 2 - Pt electrode will be the best anodic electrode. It means that the partial replacement of ruthenium oxide by lanthanum oxide in composite oxide electrode will be an effective one. (author)

The possibility of the mixed valence state in the uranium intermetallic compounds: UCoGa5, U2Ru2Sn and U2RuGa8

International Nuclear Information System (INIS)

Troc, Robert

2007-01-01

The mixed valence (MV) phenomenon has been observed so far in a large number of various compounds but containing only lanthanides. These properties are usually associated with the mixing of the localised f-state and the band states. The usual valence state for magnetic uranium intermetallics is the trivalent state 5f 3 or hybridised 5f 2 6d 1 , both are nearly degenerate in energy and can compete for a stability of the compound. In some cases a gain in an energy minimum may be achieved by very fast fluctuating between these two states with a time of 10 -14 s, which does not allow to yield the ordered state even if the exchange interactions (favourite the U-U distances) would be able for that. The latter cases seem to concern the described here intermetallics: one ternary compound based on Co, UCoGa 5 , and the two uranium ternary compounds based on Ru, namely U 2 Ru 2 Sn and U 2 RuGa 8 which all crystallize in a tetragonal unit cell. All these compounds show a maximum in their temperature dependences of the magnetic susceptibility measured along and perpendicular to the c-axis. Such a behaviour, which is reminiscent of a number of Ce (Sm, Eu) and Yb compounds for which χ(T) has in the past been considered by Sales and Wohlleben (SW) by applying their ICF model or by Lawrance et al. following their scaling procedure. It turned out that these phenomenological models can also be applied to the considered here two Ru-based uranium ternaries from which some reliable energy parameters could be found. In order to further support the mixing valence scenario for the first such cases in uranium compounds presented here, the transport and thermodynamic properties are also discussed. However, some of the most important results confirming the MV state, e.g., in U 2 RuGa 8 , has recently been achieved from the inelastic neutron scattering performed in the Rutherford Appleton Laboratory on the ISIS facility. From these measurements a characteristic gap of 60 meV has been

Thin RuO2 conducting films grown by MOCVD for microelectronic applications

International Nuclear Information System (INIS)

Froehlich, K.; Cambel, V.; Machajdik, D.; Pignard, S.; Baumann, P. K.; Lindner, J.; Schumacher, M.

2002-01-01

We have prepared thin RuO 2 films by MOCVD using thermal evaporation of Ru(thd) 2 (cod) solid precursor. The films were prepared at deposition temperatures between 250 and 500 grad C on silicon and sapphire substrates. Different structure was observed for the RuO 2 films on these substrates; the films on Si substrate were polycrystalline, while X-ray diffraction analysis revealed epitaxial growth of RuO 2 on sapphire substrates. Polycrystalline RuO 2 films prepared at temperatures below 300 grad C on Si substrate exhibit smooth surface and excellent step coverage. Highly conformal growth of the RuO 2 films at low temperature and low pressure results in nearly 100% step coverage for sub-mm features with 1:1 aspect ratio. Resistivity of the polycrystalline RuO 2 at room temperature ranged between 100 and 200 μ x Ω x cm. These films are suitable for CMOS and RAM applications. (Authors)

High electrochemical performance of RuO_2–Fe_2O_3 nanoparticles embedded ordered mesoporous carbon as a supercapacitor electrode material

International Nuclear Information System (INIS)

Xiang, Dong; Yin, Longwei; Wang, Chenxiang; Zhang, Luyuan

2016-01-01

The electrode materials RuO_2 or RuO_2–Fe_2O_3 nanoparticle embedded OMC (ordered mesoporous carbon) are prepared by the method of impregnation and heating in situ. The mesoporous structure optimized the electron and proton conducting pathways, leading to the enhanced capacitive performances of the composite materials. The average nanoparticle size of RuO_2 and RuO_2–Fe_2O_3 is 2.54 and 1.96 nm, respectively. The fine RuO_2–Fe_2O_3 nanoparticles are dispersed evenly in the pore channel wall of the two-dimensional mesoporous carbon without blocking the mesoporous channel, and they have a higher specific surface area, a larger pore volume, a proper pore size and a small charge transfer impedance value. The special electrochemical capacitance of RuO_2–Fe_2O_3/OMC tested in acid electrolyte (H_2SO_4) is measured to be as high as 1668 F g"−"1, which is higher than that of RuO_2/OMC. Meanwhile, the supercapacitor properties of the RuO_2–Fe_2O_3/OMC composites show a good cycling performance of 93% capacitance retention (3000 cycles), a better reversibility, a higher energy density (134 Wh kg"−"1) and power density (4000 W kg"−"1). The composite electrode of RuO_2–Fe_2O_3/OMC, which combines a double layer capacitance with pseudo-capacitance, is proved to be suitable for ideal high performance electrode material of a hybrid supercapacitor application. - Highlights: • The nanocomposites of RuO_2–Fe_2O_3/OMC are prepared by impregnation and heating in situ. • The fine RuO_2–Fe_2O_3 nanoparticles distribute in the pore channel wall of OMC. • We discuss a reversible redox reaction mechanism of RuO_2–Fe_2O_3/OMC in acid solutions. • RuO_2–Fe_2O_3 nanoparticles embedded OMC shows a higher supercapacitive performance.

cis,cis,cis-(Acetato-κ2O,O′bis[1,2-bis(diphenylphosphanylethane-κ2P,P′]ruthenium(II 0.75-trifluoromethanesulfonate 0.25-chloride

Directory of Open Access Journals (Sweden)

João Figueira

2013-04-01

Full Text Available In the title RuII carboxylate compound, [Ru(C2H3O2(C26H24P22](CF3O3S0.75Cl0.25, the distorted tris-bidentate octahedral stereochemistry about the RuII atom in the complex cation comprises four P-atom donors from two 1,2-bis(diphenylphosphanylethane ligands [Ru—P = 2.2881 (13–2.3791 (13 Å] and two O-atom donors from the acetate ligand [Ru—O = 2.191 (3 and 2.202 (3 Å]. The disordered counter-anions are located on the same site in the structure in a 3:1 ratio, the expanded formula comprising four complex cations, three trifluoromethanesulfonate anions and one chloride anion, with two such formula units in the unit cell.

Enhanced photocurrent in RuL2(NCS)2/di-(3-aminopropyl)-viologen/SnO2/ITO system

International Nuclear Information System (INIS)

Lee, Wonjoo; Kwak, Chang Gon; Mane, R.S.; Min, Sun Ki; Cai, Gangri; Ganesh, T.; Koo, Gumae; Chang, Jinho; Cho, Byung Won; Kim, Sei-Ki; Han, Sung-Hwan

2008-01-01

A Ru(2,2'-bipyridine-4,4'-dicarboxylic acid) 2 (NCS) 2 [RuL 2 (NCS) 2 ]/di-(3-aminopropyl)-viologen (DAPV)/tin oxide (SnO 2 ) system was prepared and applied to extensive photocurrent generation with its maximum surface area. The SnO 2 thin films on tin-doped indium oxide (ITO) were prepared using the chemical bath deposition method. Then, RuL 2 (NCS) 2 /DAPV on SnO 2 /ITO was easily prepared using self-assembled monolayers (SAMs). The photocurrent measurement of the system showed an excellent photocurrent of 20 nA cm -2 under the air mass 1.5 conditions (100 mW cm -2 ), which was increased by a factor of four compared to ones without SnO 2 layers

Conductivity study of thermally stabilized RuO2/polythiophene nanocomposites

Science.gov (United States)

Hebbar, Vidyashree; Bhajantri, R. F.

2018-04-01

The polymer nanocomposites of Ruthenium oxide (RuO2) filled polythiophene (PT) were synthesized by polymerization using chemical method. The purity of the synthesized polymer composite is verified using X-Ray diffraction (XRD). The structural discrepancies of the RuO2 filled PT composites are studied by Fourier transform infrared (FT-IR) spectroscopy. The phase transition and thermal stability of the prepared composite is revised by thermal characterization such as differential scanning calorimetry (DSC) and thermogravimetric analysis (TGA). The DC conductivity of RuO2 filled PT composite in the form of pellets is calculated using current-voltage (I-V) characterization by two-probe method. The enhancement in conductivity with increased RuO2 content in PT matrix is examined, which is the required property for electrical and electronic applications in supercapacitors.

Systems of OsO4-RuO4 and Re2O7-OsO4

International Nuclear Information System (INIS)

Nisel'son, L.A.; Sokolova, T.D.; Orlov, A.M.; Shorikov, Yu.S.

1981-01-01

The meltability diagrams of the systems OsO 4 -RuO 4 and Re 2 O 7 -OsO 4 are studied using the visual-polythermal method. The OsO 4 -RuO 4 system forms a continuous series of solid solutions with practically rectilinear line of the liquidus. The Re 2 O 7 -OsO 4 system of the eutectic type has the eutectics degenerated from the side of OsO 4 . For the system OsO 4 (basis)-RuO 4 (admixture) the equilibrium coefficient of distribution is determined using the method of directed crystallization [ru

New Ru(II) complexes for dual photoreactivity: ligand exchange and (1)O2 generation.

Science.gov (United States)

Knoll, Jessica D; Albani, Bryan A; Turro, Claudia

2015-08-18

Uncovering the factors that govern the electronic structure of Ru(II)-polypyridyl complexes is critical in designing new compounds for desired photochemical reactions, and strategies to tune excited states for ligand dissociation and (1)O2 production are discussed herein. The generally accepted mechanism for photoinduced ligand dissociation proposes that population of the dissociative triplet ligand field ((3)LF) state proceeds through thermal population from the vibrationally cooled triplet metal-to-ligand charge transfer ((3)MLCT) state; however, temperature-dependent emission spectroscopy provides varied activation energies using the emission and ligand exchange quantum yields for [Ru(bpy)2(L)2](2+) (bpy = 2,2'-bipyridine; L = CH3CN or py). This suggests that population of the (3)LF state proceeds from the vibrationally excited (3)MLCT state. Because the quantum yield of ligand dissociation for nitriles is much more efficient than that for py, steric bulk was introduced into the ligand set to distort the pseudo-octahedral geometry and lower the energy of the (3)LF state. The py dissociation quantum yield with 500 nm irradiation in a series of [Ru(tpy)(NN)(py)](2+) complexes (tpy = 2,2':6',2″-terpyridine; NN = bpy, 6,6'-dimethyl-2,2'-bipyridine (Me2bpy), 2,2'-biquinoline (biq)) increases by 2-3 orders of magnitude with the sterically bulky Me2bpy and biq ligands relative to bpy. Ultrafast transient absorption spectroscopy reveals population of the (3)LF state within 3-7 ps when NN is bulky, and density functional theory calculations support stabilized (3)LF states. Dual activity via ligand dissociation and (1)O2 production can be achieved by careful selection of the ligand set to tune the excited-state dynamics. Incorporation of an extended π system in Ru(II) complexes such as [Ru(bpy)(dppn)(CH3CN)2](2+) (dppn = benzo[i]dipyrido[3,2-a:2',3'-c]phenazine) and [Ru(tpy)(Me2dppn)(py)](2+) (Me2dppn = 3,6-dimethylbenzo[i]dipyrido[3,2-a:2',3'-c]phenazine) introduces

New Ru(II) Complexes for Dual Photoreactivity: Ligand Exchange and 1O2 Generation

Science.gov (United States)

Knoll, Jessica D.; Albani, Bryan A.; Turro, Claudia

2016-01-01

CONSPECTUS Uncovering the factors that govern the electronic structure of Ru(II)–polypyridyl complexes is critical in designing new compounds for desired photochemical reactions, and strategies to tune excited states for ligand dissociation and 1O2 production are discussed herein. The generally accepted mechanism for photoinduced ligand dissociation proposes that population of the dissociative triplet ligand field (3LF) state proceeds through thermal population from the vibrationally cooled triplet metal-to-ligand charge transfer (3MLCT) state; however, temperature-dependent emission spectroscopy provides varied activation energies using the emission and ligand exchange quantum yields for [Ru(bpy)2(L)2]2+ (bpy = 2,2′-bipyridine; L = CH3CN or py). This suggests that population of the 3LF state proceeds from the vibrationally excited 3MLCT state. Because the quantum yield of ligand dissociation for nitriles is much more efficient than that for py, steric bulk was introduced into the ligand set to distort the pseudo-octahedral geometry and lower the energy of the 3LF state. The py dissociation quantum yield with 500 nm irradiation in a series of [Ru(tpy)(NN)(py)]2+ complexes (tpy = 2,2′:6′,2″-terpyridine; NN = bpy, 6,6′-dimethyl-2,2′-bipyridine (Me2bpy), 2,2′-biquinoline (biq)) increases by 2–3 orders of magnitude with the sterically bulky Me2bpy and biq ligands relative to bpy. Ultrafast transient absorption spectroscopy reveals population of the 3LF state within 3–7 ps when NN is bulky, and density functional theory calculations support stabilized 3LF states. Dual activity via ligand dissociation and 1O2 production can be achieved by careful selection of the ligand set to tune the excited-state dynamics. Incorporation of an extended π system in Ru(II) complexes such as [Ru(bpy)(dppn)(CH3CN)2]2+ (dppn = benzo[i]dipyrido[3,2-a:2′,3′-c]phenazine) and [Ru(tpy)(Me2dppn)(py)]2+ (Me2dppn = 3,6-dimethylbenzo[i]dipyrido[3,2-a:2′,3�

RuO2 pH Sensor with Super-Glue-Inspired Reference Electrode

OpenAIRE

Lonsdale, Wade; Wajrak, Magdalena; Alameh, Kamal

2017-01-01

A pH-sensitive RuO2 electrode coated in a commercial cyanoacrylate adhesive typically exhibits very low pH sensitivity, and could be paired with a RuO2 working electrode as a differential type pH sensor. However, such sensors display poor performance in real sample matrices. A pH sensor employing a RuO2 pH-sensitive working electrode and a SiO2-PVB junction-modified RuO2 reference electrode is developed as an alternative high-performance solution. This sensor exhibits a performance similar to...

Removal of emerging pollutants by Ru/TiO2-catalyzed permanganate oxidation.

Science.gov (United States)

Zhang, Jing; Sun, Bo; Xiong, Xinmei; Gao, Naiyun; Song, Weihua; Du, Erdeng; Guan, Xiaohong; Zhou, Gongming

2014-10-15

TiO2 supported ruthenium nanoparticles, Ru/TiO2 (0.94‰ as Ru), was synthesized to catalyze permanganate oxidation for degrading emerging pollutants (EPs) with diverse organic moieties. The presence of 1.0 g L(-1) Ru/TiO2 increased the second order reaction rate constants of bisphenol A, diclofenac, acetaminophen, sulfamethoxazole, benzotriazole, carbamazepine, butylparaben, diclofenac, ciprofloxacin and aniline at mg L(-1) level (5.0 μM) by permanganate oxidation at pH 7.0 by 0.3-119 times. The second order reaction rate constants of EPs with permanganate or Ru/TiO2-catalyzed permanganate oxidation obtained at EPs concentration of mg L(-1) level (5.0 μM) underestimated those obtained at EPs concentration of μg L(-1) level (0.050 μM). Ru/TiO2-catalyzed permanganate could decompose a mixture of nine EPs at μg L(-1) level efficiently and the second order rate constant for each EP was not decreased due to the competition of other EPs. The toxicity tests revealed that Ru/TiO2-catalyzed permanganate oxidation was effective not only for elimination of EPs but also for detoxification. The removal rates of sulfamethoxazole by Ru/TiO2-catalyzed permanganate oxidation in ten successive cycles remained almost constant in ultrapure water and slightly decreased in Songhua river water since the sixth run, indicating the satisfactory stability of Ru/TiO2. Ru/TiO2-catalyzed permanganate oxidation was selective and could remove selected EPs spiked in real waters more efficiently than chlorination. Therefore, Ru/TiO2-catalyzed permanganate oxidation is promising for removing EPs with electron-rich moieties. Copyright © 2014 Elsevier Ltd. All rights reserved.

(E-1-(2-Aminophenyl-3-(4-chlorophenylprop-2-en-1-one

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Rodrigo Abonia

2016-10-01

Full Text Available The title chalcone (E-1-(2-aminophenyl-3-(4-chlorophenylprop-2-en-1-one was prepared with an excellent yield from a Claisen–Schmidt condensation reaction between o-aminoacetophenone and p-chlorobenzaldehyde. This product will be used as a key precursor for the development of an alternative route for the total synthesis of dubamine and graveoline alkaloids. Single crystals of the title compound suitable for X-ray diffraction were grown via slow evaporation in ethanol at room temperature. A complete crystallographic study was performed in depth to unequivocally confirm its structure and determine some interesting supramolecular properties. The crystal structure of the title o-aminochalcone, C15H12ClNO, shows two molecules per asymmetric unit (Z′ = 2 and adopts an E configuration about the C=C double bond. In the title compound, the mean plane of the non-H atoms of the central chalcone fragment C—C(O—C—C—C is as follows: [r.m.s. deviation = 0.0130 Å for A-B and 0.0043 for C-D molecules]. In the crystal, molecules are linked by N—H...N and C—H...O, hydrogen bonds forming edge-fused R66(46 rings parallel to (100. Additionally, N—H...O hydrogen bonds generate a three-dimensional network.

Synthesis of Nanocrystalline RuO2(60%)-SnO2(40%)Powders by Amorphous Citrate Route

Institute of Scientific and Technical Information of China (English)

无

2007-01-01

Nanometer RuO2-SnO2was synthesized by the citrate-gel method using RuCl3, SnCl4 as cation sources, citric acid as complexing agent and anhydrous ethanol as solvent. The structures of the derived powders were characterized by thermogravimetric and differential thermal analysis, X-ray diffraction, transmission electron microscope, and Brunauer-Emmett-Teller surface area measurement. The pure, fine and amorphous powders was obtained at 160℃. The materials calcined at above 400 ℃ were composed of rutile-type oxide phases having particle sizes of fairly narrow distribution and good thermal resistant properties. By adding SnO2 to RUO2, the Ru metallic phase can be effectively controlled under a traditional temperature of preparation for dimensional stable anode.

Spray pyrolysed Ru:TiO2 thin film electrodes prepared for electrochemical supercapacitor

Science.gov (United States)

Fugare, B. Y.; Thakur, A. V.; Kore, R. M.; Lokhande, B. J.

2018-04-01

Ru doped TiO2 thin films are prepared by using 0.06 M aqueous solution of potassium titanium oxalate (pto), and 0.005 M aqueous solution of ruthenium tri chloride (RuCl3) precursors. The deposition was carried on stainless steel (SS) by using well known ultrasonic spray pyrolysis technique (USPT) at 723° K by maintaining the spray rate 12 cc/min and compressed air flow rate 10 Lmin-1. Prepared Ru:TiO2 thin films were characterized by structurally, morphologically and electrochemically. Deposited RuO2 shows amorphous structure and TiO2 shows tetragonal crystal structure with rutile as prominent phase at very low decomposition temperature. SEM micrographs of RuO2 exhibits porous, interconnected, spherical grains type morphology and TiO2 shows porous, nanorods and nanoplates like morphology and also Ru doped TiO2 shows porous, spherical, granular and nanorods type morphology. The electrochemical cyclic voltammetery shows mixed capacitive behavior. The achieved highest value of specific capacitance 2692 F/g was Ru doped TiO2 electrode in 0.5 M H2SO4.

(Z-Ethyl 3-(4-chlorophenyl-2-cyano-3-(2,6-difluorobenzamidoacrylate

Directory of Open Access Journals (Sweden)

Zhang Xiaoyan

2008-12-01

Full Text Available The title compound, C19H13ClF2N2O3, was prepared by the reaction of (Z-ethyl 3-amino-3-(4-chlorophenyl-2-cyanoacrylate and 2,6-difluorobenzoyl chloride. The dihedral angle between the chlorobenzene and fluorobenzene rings is 37.0 (1°. The ethyl group is disordered over two positions [occupancies = 0.52 (2:0.48 (2]. In addition to intramolecular N—H...O and N—H...F hydrogen bonds, the crystal packing shows the molecules to be connected by intermolecular C—H...O and C—H...N hydrogen bonds.

Soft template synthesis of mesoporous Co3O4/RuO2.xH2O composites for electrochemical capacitors

International Nuclear Information System (INIS)

Liu Yang; Zhao Weiwei; Zhang Xiaogang

2008-01-01

Co 3 O 4 /RuO 2 .xH 2 O composites with various Ru content (molar content of Ru = 5%, 10%, 20%, 50%) were synthesized by one-step co-precipitation method. The precursors were prepared via adjusting pH of the mixed aqueous solutions of Co(NO 3 ) 2 .6H 2 O and RuCl 3 .0.5H 2 O by using Pluronic123 as a soft template. For the composite with molar ratio of Co:Ru = 1:1 annealed at 200 deg. C, Brunauer-Emmet-Teller (BET) results indicated that the composite showed mesoporous structure, and the specific surface area of the composite was as high as 107 m 2 g -1 . The electrochemical performances of these composites were measured in 1 M KOH electrolyte. Compared with the composite prepared without template, the composite with P123 exhibited a higher specific capacitance. When the molar content of Ru was rising, the specific capacitance of the composites increased significantly. It was also observed that the crystalline structures as well as the electrochemical activities were strongly dependent on the annealing temperature. A capacitance of 642 F/g was obtained for the composite (Co:Ru = 1:1) annealed at 150 deg. C. Meanwhile, the composites also exhibited good cycle stability. Besides, the morphologies and textural characteristic of the samples were also investigated by X-ray diffraction (XRD), transmission electron microscopy (TEM)

Enhanced thermal stability of RuO2/polyimide interface for flexible device applications

Science.gov (United States)

Music, Denis; Schmidt, Paul; Chang, Keke

2017-09-01

We have studied the thermal stability of RuO2/polyimide (Kapton) interface using experimental and theoretical methods. Based on calorimetric and spectroscopic analyses, this inorganic-organic system does not exhibit any enthalpic peaks as well as all bonds in RuO2 and Kapton are preserved up to 500 °C. In addition, large-scale density functional theory based molecular dynamics, carried out in the same temperature range, validates the electronic structure and points out that numerous Ru-C and a few Ru-O covalent/ionic bonds form across the RuO2/Kapton interface. This indicates strong adhesion, but there is no evidence of Kapton degradation upon thermal excitation. Furthermore, RuO2 does not exhibit any interfacial bonds with N and H in Kapton, providing additional evidence for the thermal stability notion. It is suggested that the RuO2/Kapton interface is stable due to aromatic architecture of Kapton. This enhanced thermal stability renders Kapton an appropriate polymeric substrate for RuO2 containing systems in various applications, especially for flexible microelectronic and energy devices.

Highly anisotropic magnon dispersion in Ca{sub 2}RuO{sub 4}. Evidence for strong spin orbit coupling

Energy Technology Data Exchange (ETDEWEB)

Kunkemoeller, Stefan; Khomskii, Daniel; Braden, Markus [II. Physikalisches Institut, Universitaet zu Koeln (Germany); Steffens, Paul; Piovano, Andrea [Institut Laue Langevin, Grenoble (France); Nugroho, Augustinus Agung [Institut Teknologi Bandung (Indonesia)

2016-07-01

Ca{sub 2}RuO{sub 4} is a key material for the understanding of the impact of spin-orbit coupling in 4d and 5d compounds, which is intensively studied at present. We have studied the magnon dispersion in Ca{sub 2}RuO{sub 4} by inelastic neutron scattering on large single crystals containing 1% of Ti. With this unmagnetic substitution large single crystals could be obtained with the floating zone method. The magnon dispersion can be well described with the simple conventional Heisenberg model. Ca{sub 2}RuO{sub 4} reveals a large anisotropy gap of 13 meV, which shows that spin-orbit coupling and some in-plane orbital ordering are both important parameters for the description of the electronic and magnetic properties of Ca{sub 2}RuO{sub 4}.

Study of magnetic structure of neptunium compounds: Np As, Np Sb, Np Se et Np Ru2 Si2

International Nuclear Information System (INIS)

Bonnisseau, D.

1987-11-01

Magnetic behavior and localization of 5f electrons in actinide compounds is studied experimentally by Moessbauer spectroscopy and neutron diffraction. Binary actinide compounds with a NaCl structure are examined and properties of U, Pu and Np monopnictides and monochalcogenides are recalled. Results of neutron diffraction by NpAs and NpSb are discussed and results of magnetic susceptibility, magnetization, Moessbauer spectroscopy and neutron diffraction measurements on NpSe and NpTe are presented. Magnetic properties of NpRu 2 Si 2 are also presented. Heavy fermion system electronic and magnetic properties are described and theory is discussed. Electronic and magnetic properties of CeCu 2 Si 2 , CeRu 2 Si 2 and URu 2 Si 2 are compared to NpRu 2 Si 2 which has the same crystal structure [fr

Two component butterfly hysteresis in RuSr2EuCeCu2O1 ruthenocuprate

International Nuclear Information System (INIS)

Zivkovic, I.; Drobac, D.; Prester, M.

2006-01-01

We report detailed studies of the ac susceptibility butterfly hysteresis on the RuSr 2 EuCeCu 2 O 1 (Ru1222) ruthenocuprate compound. Two separate contributions to these hysteresis have been identified and studied. One contribution is ferromagnetic-like and is characterized by the coercive field maximum. Another contribution, represented by the so called inverted maximum, is related to the unusual inverted loops, unique feature of Ru1222 butterfly hysteresis. The different nature of the two identified magnetic contributions is proved by the different temperature dependences involved. By lowering the temperature the inverted peak gradually disappears while the coercive field slowly raises. If the maximum dc field for the hysteresis is increased, the size of the inverted part of the butterfly hysteresis monotonously grows while the position of the peak saturates. In reaching saturation exponential field dependence has been demonstrated to take place. At T = 78 K the saturation field is 42 Oe

On the solubility of yttrium in RuO2

International Nuclear Information System (INIS)

Music, Denis; Zumdick, Naemi A.; Hallstedt, Bengt; Schneider, Jochen M.

2011-01-01

We have investigated the solubility of Y in rutile RuO 2 using experimental and theoretical methods. Nanostructured Ru-Y-O thin films were synthesized via combinatorial reactive sputtering with an O/metal ratio of 2.6 and a Y content of 0.3 to 12.6 at. %. A solubility limit of 1.7 at. % was identified using x-ray photoelectron spectroscopy and x-ray diffraction. Based on ab initio and thermodynamic modeling, the solubility of Y can be understood. Smaller Y amounts are incorporated into the lattice, forming a metastable film, with local structural deformations due to size effects. As the Y content is increased, extensive local structural deformations are observed, but phase separation does not occur due to kinetic limitations. Nanostructured RuO 2 alloyed with Y might lead to enhanced phonon scattering and quantum confinement effects, which in turn improve the thermoelectric efficiency.

High temperature-induced phase transitions in Sr2GdRuO6 complex perovskite

International Nuclear Information System (INIS)

Triana, C.A.; Corredor, L.T.; Landínez Téllez, D.A.; Roa-Rojas, J.

2011-01-01

Highlights: ► Crystal structure, thermal expansion and phase transitions at high-temperature of Sr 2 GdRuO 6 perovskite has been investigated. ► X-ray diffraction pattern at 298 K of Sr 2 GdRuO 6 corresponds to monoclinic perovskite-type structure with P2 1 /n space group. ► Evolution of X-ray diffraction patterns at high-temperature shows that the Sr 2 GdRuO 6 perovskite suffers two-phase transitions. ► At 573 K the X-ray diffraction pattern of Sr 2 GdRuO 6 corresponds to monoclinic perovskite-type structure with I2/m space group. ► At 1273 K the Sr 2 GdRuO 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 2 GdRuO 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 1 /n (no. 14) space group and 1:1 ordered arrangement of Ru 5+ and Gd 3+ cations over the six-coordinate M sites. Experimental lattice parameters were obtained to be a =5.8103(5) Å, b =5.8234(1) Å, c =8.2193(9) Å, V = 278.11(2) Å 3 and angle β = 90.310(5)°. 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) Å, b = 5.8326(3) Å, c = 8.2449(2) Å, V = 280.31(3) Å 3 and angle β = 90.251(3)°. Close to 1273 K it undergoes a complete phase-transition from monoclinic I2/m (no. 12) to tetragonal I4/m (no. 87), with lattice parameters a = 5.8726(1) Å, c = 8.3051(4) Å, V = 286.39(8) Å 3 and angle β = 90.0°. The high-temperature phase transition from monoclinic I2/m (no. 12) to tetragonal I4/m (no. 87) is characterized

Preparation and electrochemical characterization of size controlled SnO2-RuO2 composite powder for monolithic hybrid battery

International Nuclear Information System (INIS)

Jeon, Young-Ah; No, Kwang-Soo; Choi, Sun Hee; Ahn, Jae pyong; Yoon, Young Soo

2004-01-01

Tin oxide (SnO 2 ) powders with a particle size of ∼20 nm were synthesized by a gas condensation method. Ruthenium oxide was loaded by an incipient-wetness method, in which an aqueous solution of RuCl 3 was added to the manufactured SnO 2 powder in an amount that was just sufficient to wet completely the powder. And then, the resulting solution was obtained after freeze-drying to synthesis the smallest particle. The as-synthesized SnO 2 powder with 1.5 wt.% ruthenium oxide (RuO 2 ) exhibited well-developed facets and had a very uniform particle size. The first discharge capacity was lower than comparing to commercial powder because of forming the second phase, but showed good cyclability. A maximum specific electrode capacitance of ∼20 F/g and a maximum specific power of ∼80 W/kg were achieved by manufactured SnO 2 with 1.5 wt.% RuO 2 . This result indicated that the synthesized SnO 2 -RuO 2 composite powder of nano-size scale is candidate for use in fabricating monolithic hybrid batteries using suitable electrolyte as well

Study of structural and transport properties of nanostructured CeO{sub 2}, Ce{sub 1-x}Ru{sub x}O{sub 2} and Ce{sub 1-x}In{sub x}O{sub 2} thin films

Energy Technology Data Exchange (ETDEWEB)

Rangel, R.; Chavez-Chavez, L. [Division de Estudios de Posgrado, Facultad de Ingenieria Quimica, Universidad Michoacana de S.N.H. (Mexico); Martinez, E. [Centro de Investigacion en Materiales Avanzados, S.C. (CIMAV), Nuevo Leon (Mexico); Bartolo-Perez, P. [Departamento de Fisica Aplicada, CINVESTAV-IPN, Merida, Yucatan (Mexico)

2012-06-15

The present work reports for the first time thin films prepared from Ce{sub 1-x}M{sub x}O{sub 2-{delta}} (M = Ru, In) solid solutions for application as gas sensors. The CeO{sub 2}, Ce{sub 0.95}Ru{sub 0.05}O{sub 2} and Ce{sub 0.95}In{sub 0.05}O{sub 2} thin films were prepared by means of the RF sputtering process onto Si (111) substrates. The deposition conditions were carried out at 500 C varying the deposition time. Targets were prepared via sol-gel process starting from C{sub 6}H{sub 9}O{sub 6}In, Ru{sub 3}(CO){sub 12} and Ce(C{sub 2}H{sub 3}O{sub 2}){sub 3} . 1.5H{sub 2}O compounds and using a ceramic method to consolidate them. The samples were characterized by means of XRD, SEM, and AFM. Their thickness was measured using a profilometer. The results herein obtained regarding the microstructure and transport properties indicate that these materials can be used as gas sensors. (Copyright copyright 2012 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

Anodic incineration of phthalic anhydride using RuO2–IrO2–SnO2–TiO2 coated on Ti anode

Directory of Open Access Journals (Sweden)

S. Chellammal

2016-11-01

Full Text Available Phthalic anhydride is a toxic and non-biodegradable organic compound and is widely used for the production of dyes. This paper has investigated the electrochemical oxidation of phthalic anhydride in an undivided cell at different experimental parameters such as pH, current density and supporting electrolytes on the anode of titanium substrate coated with mixed metal oxides of RuO2, IrO2, SnO2 and TiO2 prepared by thermal decomposition method. The surface morphology and the structure of the above anode were characterized by scanning electron microscopy, electron dispersion microscopy and X-ray diffraction. The study shows that the electrode exhibits good electro catalytic activity together with chemical stability during the treatment of the phthalic anhydride. At pH 3, the maximum removal of COD of 88% with energy consumption of 30.5 kW h kg−1 was achieved by the addition of 10 g l−1 NaCl in 0.2 mol dm−3 Na2SO4 at 5 Adm−2. This electrolytic investigation offers an attractive alternative method for the destruction of industrial effluents contaminated with phthalic anhydride.

Effect of TiO_2 Loading on Pt-Ru Catalysts During Alcohol Electrooxidation

International Nuclear Information System (INIS)

Hasa, Bjorn; Kalamaras, Evangelos; Papaioannou, Evangelos I.; Vakros, John; Sygellou, Labrini; Katsaounis, Alexandros

2015-01-01

Highlights: • TiO_2 can be used to modify Pt-Ru based electrodes for alcohol oxidation. • TiO_2 modified electrodes with lower amount of metals had higher active surface area than pure Pt-Ru electrodes. • TiO_2 modified electrodes showed comparable performance with pure Pt-Ru electrode both in a single cell and in a PEM fuel cell under alcohol fuelling. - Abstract: In this study, Pt-Ru based electrodes modified by TiO_2 were prepared by means of thermal decomposition of chloride and isopropoxide precursors on Ti substrates, characterised by X-ray Diffraction (XRD), Scanning Electron Microscopy (SEM), X-ray Photoelectron Spectroscopy (XPS), electrochemical techniques and CO stripping and used as anodes for alcohol oxidation. The minimization of the metal loading without electrocatalytic activity losses was also explored. TiO_2 was chosen due to its chemical stability, low cost and excellent properties as substrate for metal dispersion. It was found that TiO_2 loading up to 50% results in a 3-fold increase of the Electrochemically Active Surface (EAS). This conclusion has been confirmed by CO stripping experiments. All samples have been evaluated during the electrochemical oxidation of methanol, ethanol and glycerol. In all cases, the Pt_2_5-Ru_2_5-(TiO_2)_5_0 electrode had better electrocatalytic activity than the pure Pt_5_0-Ru_5_0 anode. The best modified electrode, (Pt_2_5-Ru_2_5-(TiO_2)_5_0), was also evaluated as anode in a PEM fuel cell under methanol fuelling conditions. The observed higher performance of the TiO_2 modified electrodes was attributed to the enhanced Pt-Ru dispersion as well as the formation of smaller Pt and Ru particles.

Electrooxidation as the anaerobic pre-treatment of fats: oleate conversion using RuO2 and IrO2 based anodes.

Science.gov (United States)

Gonçalves, M; Alves, M M; Correia, J P; Marques, I P

2008-11-01

Electrochemical treatment of oleate using RuO2 and IrO2 type dimensionally stable anodes in alkaline medium was performed to develop a feasible anaerobic pre-treatment of fatty effluents. The results showed that the pre-treated solutions over RuO2 were faster degraded by anaerobic consortium than the raw oleate solutions or the electrolysed solutions using IrO2. In batch experiments carried out with pre-treated solutions over RuO2 (100-500mg/L), no lag phases were observed before the methane production onset. On the other hand, raw oleate and pre-treated oleate over IrO2 had originated lag phases of 0-140 and 0-210h, respectively. This study demonstrated that it is advantageous to apply the electrochemical treatment carried out on the RuO2 type DSA in order to achieve a faster biodegradation of lipid-containing effluent and consequently to obtain a faster methane production.

Addition of IrO2 to RuO2+TiO2 coated anodes and its effect on electrochemical performance of anodes in acid media

Directory of Open Access Journals (Sweden)

Farhad Moradi

2014-04-01

Full Text Available Ternary mixed metal oxide coatings with the nominal composition IrxRu(0.6−xTi0.4O2 (x=0, 0.1, 0.2, 0.3 on the titanium substrate were prepared by thermal decomposition of a chloride precursor mixture. Surface morphology and microstructure of the coatings were investigated by Scanning electron microscopy (SEM, Field emission scanning electron microscopy (FE-SEM and X-ray diffraction (XRD analysis. Systematic study of electrochemical properties of these coatings was performed by cyclic voltammetry (CV and polarization measurements. The corrosion behavior of the coatings was evaluated under accelerated conditions (j=2 A cm−2 in acidic electrolyte. The role of iridium oxide admixture in the change of electrocatalytic activity and stability of Ru0.6Ti0.4O2 coating was discussed. Small addition of IrO2 can improve the stability of the RuO2+TiO2 mixed oxide, while the electrocatalytic activity for oxygen evolution reaction (OER is decreased. The shift of redox potentials for Ru0.6Ti0.4O2 electrode that is slightly activated with IrO2 and improvement in the stability can be attributed to the synergetic effect of mixed oxide formation.

Local structure distortion induced by Ti dopants boosting the pseudocapacitance of RuO2-based supercapacitors

Science.gov (United States)

Chen, I.-Li; Wei, Yu-Chen; Lu, Kueih-Tzu; Chen, Tsan-Yao; Hu, Chi-Chang; Chen, Jin-Ming

2015-09-01

Binary oxides with atomic ratios of Ru/Ti = 90/10, 70/30, and 50/50 were fabricated using H2O2-oxidative precipitation with the assistance of a cetyltrimethylammonium bromide (CTAB) template, followed by a thermal treatment at 200 °C. The characteristics of electron structure and local structure extracted from X-ray absorption spectroscopy (XAS) and transmission electron microscopy (TEM) analyses indicate that incorporation of Ti into the RuO2 lattice produces not only the local structural distortion of the RuO6 octahedra in (Ru-Ti)O2 with an increase in the central Ru-Ru distance but also a local crystallization of RuO2. Among the three binary oxides studied, (Ru70-Ti30)O2 exhibits a capacitance improvement of about 1.4-fold relative to the CTAB-modified RuO2, mainly due to the enhanced crystallinity of the distorted RuO6 structure rather than the surface area effect. Upon increasing the extent of Ti doping, the deteriorated supercapacitive performance of (Ru50-Ti50)O2 results from the formation of localized nano-clusters of TiO2 crystallites. These results provide insight into the important role of Ti doping in RuO2 that boosts the pseudocapacitive performance for RuO2-based supercapacitors. The present result is crucial for the design of new binary oxides for supercapacitor applications with extraordinary performance.Binary oxides with atomic ratios of Ru/Ti = 90/10, 70/30, and 50/50 were fabricated using H2O2-oxidative precipitation with the assistance of a cetyltrimethylammonium bromide (CTAB) template, followed by a thermal treatment at 200 °C. The characteristics of electron structure and local structure extracted from X-ray absorption spectroscopy (XAS) and transmission electron microscopy (TEM) analyses indicate that incorporation of Ti into the RuO2 lattice produces not only the local structural distortion of the RuO6 octahedra in (Ru-Ti)O2 with an increase in the central Ru-Ru distance but also a local crystallization of RuO2. Among the three binary

RuO2 pH Sensor with Super-Glue-Inspired Reference Electrode

Directory of Open Access Journals (Sweden)

Wade Lonsdale

2017-09-01

Full Text Available A pH-sensitive RuO2 electrode coated in a commercial cyanoacrylate adhesive typically exhibits very low pH sensitivity, and could be paired with a RuO2 working electrode as a differential type pH sensor. However, such sensors display poor performance in real sample matrices. A pH sensor employing a RuO2 pH-sensitive working electrode and a SiO2-PVB junction-modified RuO2 reference electrode is developed as an alternative high-performance solution. This sensor exhibits a performance similar to that of a commercial glass pH sensor in some common sample matrices, particularly, an excellent pH sensitivity of 55.7 mV/pH, a hysteresis as low as 2.7 mV, and a drift below 2.2 mV/h. The developed sensor structure opens the way towards the development of a simple, cost effective, and robust pH sensor for pH analysis in various sample matrices.

RuO2 pH Sensor with Super-Glue-Inspired Reference Electrode

Science.gov (United States)

Wajrak, Magdalena; Alameh, Kamal

2017-01-01

A pH-sensitive RuO2 electrode coated in a commercial cyanoacrylate adhesive typically exhibits very low pH sensitivity, and could be paired with a RuO2 working electrode as a differential type pH sensor. However, such sensors display poor performance in real sample matrices. A pH sensor employing a RuO2 pH-sensitive working electrode and a SiO2-PVB junction-modified RuO2 reference electrode is developed as an alternative high-performance solution. This sensor exhibits a performance similar to that of a commercial glass pH sensor in some common sample matrices, particularly, an excellent pH sensitivity of 55.7 mV/pH, a hysteresis as low as 2.7 mV, and a drift below 2.2 mV/h. The developed sensor structure opens the way towards the development of a simple, cost effective, and robust pH sensor for pH analysis in various sample matrices. PMID:28878182

O2-enhanced methanol oxidation reaction at novel Pt-Ru-C co-sputtered electrodes

International Nuclear Information System (INIS)

Umeda, Minoru; Matsumoto, Yosuke; Inoue, Mitsuhiro; Shironita, Sayoko

2013-01-01

Highlights: ► Novel Pt-Ru-C electrodes were prepared by a co-sputtering technique. ► Co-sputtered electrodes with C result in highly efficient O 2 -enhanced methanol oxidation. ► Pt–Ru-alloy-based co-sputtered electrode induces a negative onset potential of methanol oxidation. ► The Pt-Ru-C electrodes allow a negative onset potential of O 2 -enhanced methanol oxidation. ► The optimum atomic ratios of Pt-Ru-C are Pt: 0.24–0.80, Ru: 0.14–0.61, C: 0.06–0.37. -- Abstract: A Pt-Ru-C electrode has been developed using a co-sputtering technique for use as the anode catalyst of a mixed-reactant fuel cell. The physical and electrochemical characteristics of the electrodes demonstrate that co-sputtered Pt and Ru form a Pt–Ru alloy. The crystallite sizes of the catalysts investigated in this study are reduced by the addition of C to the Pt–Ru alloy. Cu stripping voltammograms suggest that the sputtering of C and the formation of the Pt–Ru alloy synergically increase the electrochemical surface area of the electrodes. The methanol oxidation performances of the prepared electrodes were evaluated in N 2 and O 2 atmospheres; the Pt-Ru-C electrodes achieve an O 2 -induced negative shift in the onset potential of the methanol oxidation (E onset ) and enhance the methanol oxidation current density in the O 2 atmosphere. The mechanism of O 2 -enhanced methanol oxidation with a negative E onset at the Pt-Ru-C electrodes is attributed to a change in the electronic structure of Pt due to the formation of Pt–Ru alloy and the generation of O-based adsorption species by the reduction of O 2 . Finally, the composition of the Pt-Ru-C electrode for the O 2 -enhanced methanol oxidation with a negative E onset was found to be optimal at an atomic ratio of Pt: 0.24–0.80, Ru: 0.14–0.61, and C: 0.06–0.37

Steam and CO2 reforming of methane over a Ru/ZrO2 catalyst

DEFF Research Database (Denmark)

Jakobsen, Jon Geest; Jørgensen, T.L.; Chorkendorff, Ib

2010-01-01

The kinetics of methane steam reforming over a Ru/ZrO2 catalyst was studied at 1.3 bar total pressure and in the temperature range 425-575 degrees C. These data were fitted by combining a reactor model with a series of kinetic models. The best fit was obtained by a model with methane dissociative...... adsorption as the rate limiting step and with CO and H adspecies partly blocking the active sites. The Ru/ZrO2 catalyst was characterized by TEM and H-2 chemisorption. By comparison of ex situ and in situ TEM, it is evident that Ru particles with diameters of...

Orientation-Dependent Oxygen Evolution on RuO ₂ without Lattice Exchange

Energy Technology Data Exchange (ETDEWEB)

Stoerzinger, Kelsey A.; Diaz-Morales, Oscar; Kolb, Manuel; Rao, Reshma R.; Frydendal, Rasmus; Qiao, Liang; Wang, Xiao Renshaw; Halck, Niels Bendtsen; Rossmeisl, Jan; Hansen, Heine A.; Vegge, Tejs; Stephens, Ifan E. L.; Koper, Marc T. M.; Shao-Horn, Yang

2017-03-15

RuO2 catalysts exhibit record activities towards the oxygen evolution reaction (OER), which is crucial to enable efficient and sustainable energy storage. Here we examine the RuO2 OER kinetics on rutile (110), (100), (101), and (111) orientations, finding (100) the most active. We assess the potential involvement of lattice oxygen in the OER mechanism with online 3 electrochemical mass spectrometry, which showed no evidence of oxygen exchange on these oriented facets in acidic or basic electrolytes. Similar results were obtained for polyoriented RuO2 films and particles, in contrast to previous work, suggesting lattice oxygen is not exchanged in catalyzing OER on crystalline RuO2 surfaces. This hypothesis is supported by the correlation of activity with the number of active Ru-sites calculated by DFT, where more active facets bind oxygen more weakly. This new understanding of the active sites provides a design strategy to enhance the OER activity of RuO2 nanoparticles by facet engineering.

Electronic and elastic properties of new semiconducting oP12-type RuB2 and OsB2

International Nuclear Information System (INIS)

Hao Xianfeng; Xu Yuanhui; Gao Faming

2011-01-01

Using first-principles total energy calculations we investigate the structural, elastic and electronic properties of new hypothetical oP 12 -type phase RuB 2 and OsB 2 . The calculations indicate that the oP 12 -type phase RuB 2 and OsB 2 are thermodynamically and mechanically stable. Remarkably, the new phases RuB 2 and OsB 2 are predicted to be semiconductors, and the appearance of band gaps is ascribed to the enhanced B-B covalent hybridization. Compared to metallic oP 6 -type RuB 2 and OsB 2 phases, the new phases possess similar mechanical properties and hardness. The combination of the probability of tunable electronic properties, strong stiffness and high hardness make RuB 2 and OsB 2 attractive and interesting for advanced applications.

Magnetic, electrical and structural properties of the Re-doped ruthenocuprate Ru{sub 1−x}Re{sub x}Sr{sub 2}GdCu{sub 2}O{sub y}

Energy Technology Data Exchange (ETDEWEB)

Corredor, L.T. [Departamento de Física, Universidade Federal de Pernambuco, 50670-901 Recife, PE (Brazil); Programa de Pós-Graduação em Ciências de Materiais-CCEN, Universidade Federal de Pernambuco, 50670-901 Recife, PE (Brazil); Grupo de Física de Nuevos Materiales, Departamento de Física, Universidad Nacional de Colombia, Bogotá D.C. (Colombia); Albino Aguiar, J. [Departamento de Física, Universidade Federal de Pernambuco, 50670-901 Recife, PE (Brazil); Programa de Pós-Graduação em Ciências de Materiais-CCEN, Universidade Federal de Pernambuco, 50670-901 Recife, PE (Brazil); Landínez Téllez, D.A. [Grupo de Física de Nuevos Materiales, Departamento de Física, Universidad Nacional de Colombia, Bogotá D.C. (Colombia); Pureur, P.; Mesquita, F. [Instituto de Física, Universidade Federal do Rio Grande do Sul, 91501-970 Porto Alegre, RS (Brazil); Roa-Rojas, J. [Grupo de Física de Nuevos Materiales, Departamento de Física, Universidad Nacional de Colombia, Bogotá D.C. (Colombia)

2015-06-15

Highlights: • We investigated the effect of the dilution of magnetic Ru sub-lattice of RuSr{sub 2}GdCu{sub 2}O{sub 8}. • We synthesized the doped compound Rui{sub x}Re{sub x}Sr{sub 2}GdCu{sub 2}O{sub y}, for 3%, 6%, 9% and 12% Re. • Re would affect the electron coupling: just 3 and 6% samples were superconductor. • Superconductivity emergence strongly affects magnetic properties of 3 and 6% samples. • A weak ferromagnetic component is consistent with a globally antiferromagnetic system. - Abstract: Despite the discovery of new superconductors classes, high-Tc oxides continue to be a current topic, because of their complex phase diagrams and doping-dependant effects (allowing one to investigate the interaction between orbitals), as well as structural properties such as lattice distortion and charge ordering, among many others. Ruthenocuprates are magnetic superconductors in which the magnetic transition temperature is much higher than the critical superconducting temperature, making them unique compounds. With the aim of investigating the dilution of the magnetic Ru sub-lattice, we proposed the synthesis of the Ru{sub 1−x}Re{sub x}Sr{sub 2}GdCu{sub 2}O{sub y} ruthenocuprate-type family, adapting the known two-step process (double perovskite + CuO) by directly doping the double perovskite, thus obtaining the perovskite compound Sr{sub 2}GdRu{sub 1−x}Re{sub x}O{sub y}, which represents a new synthesis process to the best of our knowledge. Our samples were structurally characterized through X-ray diffraction, and the patterns were analysed via Rietveld refinement. A complete magnetic characterization as a function of temperature and applied field, as well as transport measurements were carried out. We discuss our results in the light of the two-lattice model for ruthenocuprates, and a relation between RuO{sub 2} (magnetic) and CuO{sub 2} (superconductor) sub-lattices can clearly be observed.

Characterization of RuO sub 2 electrodes for ferroelectric thin films prepared by metal-organic chemical-vapor deposition using Ru(C sub 1 sub 1 H sub 1 sub 9 O sub 2) sub 3

CERN Document Server

Lee, J M; Shin, J C; Hwang, C S; Kim, H J; Suk, C G

1999-01-01

Pure and conducting RuO sub 2 thin films were deposited on Si substrates at 250 approx 450 .deg. C using Ru(C sub 1 sub 1 H sub 1 sub 9 O sub 2) sub 3 as a precursor by low-pressure metal-organic chemical-vapor deposition (LP-MOCVD). At a lower deposition temperature,smoother and denser RuO sub 2 thin films were deposited. The RuO sub 2 thin films, which were crack free, adhered well onto the substrates and showed very low resistivities around 45 approx 60 mu OMEGA cm. RuO sub 2 thin films on (Ba, Sr)/TiO sub 3 /Pt/SiO sub 2 /Si showed good properties, indicating that MOCVD RuO sub 2 thin films from Ru(C sub 1 sub 1 H sub 1 sub 9 O sub 2) sub 3 can be applied as electrodes of high-dielectric thin films for capacitors in ultra-large-scale DRAMs.

Annealing effect on the performance of RuO{sub 2}-Ta{sub 2}O{sub 5}/Ti electrodes for use in supercapacitors

Energy Technology Data Exchange (ETDEWEB)

Chen, Ho-Rei; Lai, Huen-Hua [Department of Chemical and Materials Engineering, National Kaohsiung University of Applied Sciences, Kaohsiung, 80782 Taiwan (China); Jow, Jiin-Jiang, E-mail: jjjow@cc.kuas.edu.tw [Department of Chemical and Materials Engineering, National Kaohsiung University of Applied Sciences, Kaohsiung, 80782 Taiwan (China)

2011-02-15

The preparation of RuO{sub 2}-Ta{sub 2}O{sub 5}/Ti electrodes, by dip-coating, for use in supercapacitors was investigated. The stability and specific capacitance of the electrodes annealed at various temperatures was examined. The results show that highly stable electrodes with a specific capacitance of 170 F g RuO{sub 2}{sup -1} were obtained at approximately 250 deg. C, while electrodes with a lower capacitance (130 F g RuO{sub 2}{sup -1}) were obtained at 300 deg. C. The annealing time needed to obtain a stable RuO{sub 2}-Ta{sub 2}O{sub 5}/Ti electrode at various temperatures correlates well with the Arrhenius' law: with the activation energy (E) of the annealing reactions for the electrodes being estimated as 73.5 kJ mol{sup -1}. SEM images of the electrodes show the coating films to have rough surface morphology with cracks 2-6 {mu}m in width. XRD data indicate that the coating films obtained are composed of crystalline RuO{sub 2} and amorphous tantalum oxide.

cis-Bis(O-methyl-dithio-carbonato-κ(2) S,S')bis-(tri-phenyl-phosphane-κP)ruthenium(II).

Science.gov (United States)

Valerio-Cárdenas, Cintya; Hernández-Ortega, Simón; Reyes-Martínez, Reyna; Morales-Morales, David

2013-01-01

In the title compound, [Ru(CH3OCS2)2(C18H15P)2], the Ru(II) atom is in a distorted octa-hedral coordination by two xanthate anions (CH3OCS2) and two tri-phenyl-phosphane (PPh3) ligands. Both bidentate xanthate ligands coordinate the Ru(II) atom with two slightly different Ru-S bond lengths but with virtually equal bite angles [71.57 (4) and 71.58 (3)°]. The packing of the complexes is assured by C-H⋯O and C-H⋯π inter-actions.

Role of yttria-stabilized zirconia produced by ion-beam-assisted deposition on the properties of RuO2 on SiO2/Si

International Nuclear Information System (INIS)

Jia, Q.X.; Arendt, P.; Groves, J.R.; Fan, Y.; Roper, J.M.; Foltyn, S.R.

1998-01-01

Highly conductive biaxially textured RuO 2 thin films were deposited on technically important SiO 2 /Si substrates by pulsed laser deposition, where yttria-stabilized zirconia (YSZ) produced by ion-beam-assisted-deposition (IBAD) was used as a template to enhance the biaxial texture of RuO 2 on SiO 2 /Si. The biaxially oriented RuO 2 had a room-temperature resistivity of 37 μΩ-cm and residual resistivity ratio above 2. We then deposited Ba 0.5 Sr 0.5 TiO 3 thin films on RuO 2 /IBAD-YSZ/SiO 2 /Si. The Ba 0.5 Sr 0.5 TiO 3 had a pure (111) orientation normal to the substrate surface and a dielectric constant above 360 at 100 kHz. copyright 1998 Materials Research Society

Electronic and elastic properties of new semiconducting oP(12)-type RuB(2) and OsB(2).

Science.gov (United States)

Hao, Xianfeng; Xu, Yuanhui; Gao, Faming

2011-03-30

Using first-principles total energy calculations we investigate the structural, elastic and electronic properties of new hypothetical oP(12)-type phase RuB(2) and OsB(2). The calculations indicate that the oP(12)-type phase RuB(2) and OsB(2) are thermodynamically and mechanically stable. Remarkably, the new phases RuB(2) and OsB(2) are predicted to be semiconductors, and the appearance of band gaps is ascribed to the enhanced B-B covalent hybridization. Compared to metallic oP(6)-type RuB(2) and OsB(2) phases, the new phases possess similar mechanical properties and hardness. The combination of the probability of tunable electronic properties, strong stiffness and high hardness make RuB(2) and OsB(2) attractive and interesting for advanced applications. © 2011 IOP Publishing Ltd

On the solubility of yttrium in RuO{sub 2}

Energy Technology Data Exchange (ETDEWEB)

Music, Denis; Zumdick, Naemi A.; Hallstedt, Bengt; Schneider, Jochen M. [Materials Chemistry, RWTH Aachen University, D-52056 Aachen (Germany)

2011-09-01

We have investigated the solubility of Y in rutile RuO{sub 2} using experimental and theoretical methods. Nanostructured Ru-Y-O thin films were synthesized via combinatorial reactive sputtering with an O/metal ratio of 2.6 and a Y content of 0.3 to 12.6 at. %. A solubility limit of 1.7 at. % was identified using x-ray photoelectron spectroscopy and x-ray diffraction. Based on ab initio and thermodynamic modeling, the solubility of Y can be understood. Smaller Y amounts are incorporated into the lattice, forming a metastable film, with local structural deformations due to size effects. As the Y content is increased, extensive local structural deformations are observed, but phase separation does not occur due to kinetic limitations. Nanostructured RuO{sub 2} alloyed with Y might lead to enhanced phonon scattering and quantum confinement effects, which in turn improve the thermoelectric efficiency.

Reduced cobalt phases of ZrO2 and Ru/ZrO2 promoted cobalt catalysts and product distributions from Fischer–Tropsch synthesis

International Nuclear Information System (INIS)

Kangvansura, Praewpilin; Schulz, Hans; Suramitr, Anwaraporn; Poo-arporn, Yingyot; Viravathana, Pinsuda; Worayingyong, Attera

2014-01-01

Highlights: • Ru/ZrO 2 , ZrO 2 promoted Co/SiO 2 for FTS were reduced by time resolved XANES. • Reduced catalysts resulted from XANES reduction showed the mixed phases of Co, CoO. • The highest percentages of CoO resulted from the high ZrO 2 promoted Co/SiO 2 . • Product distributions of 1-alkenes, iso-alkanes indicated sites for FTS and the 2° reaction. • Alkene readsorption were high corresponding to the high CoO forming branched alkanes. - Abstract: Co/SiO 2 catalysts were promoted with 4% and 8% ZrO 2 . Small amounts (0.07%) of Ru were impregnated onto 4%ZrO 2 /Co/SiO 2 . Catalysts resulting from time-resolved XANES reduction showed mixed phases of Co and CoO, with the highest percentages of Co resulting from Ru/4%ZrO 2 /Co/SiO 2 and the highest percentages of CoO resulting from 8%ZrO 2 /Co/SiO 2 . Product distributions of n-alkanes, iso-alkanes and alkenes during Fischer–Tropsch Synthesis (FTS) were used to investigate the catalyst performance of 4%ZrO 2 /Co/SiO 2 8%ZrO 2 /Co/SiO 2 and Ru/4%ZrO 2 /Co/SiO 2 . FTS steady state was studied by growth probabilities of n-alkane products. No 1-alkene was produced from Ru/4%ZrO 2 /Co/SiO 2 , indicating high availability of Fischer–Tropsch sites for long chain hydrocarbon growth, despite high methanation. Branched alkanes produced from the secondary reaction were related to the high CoO percentages on 8%ZrO 2 /Co/SiO 2 . Alkene readsorption sites were high, corresponding to the high CoO percentages, causing a high probability of forming branched alkane products

Rotational and translational distortions of the crystal structure of the Sr2HrRuO6 (Hr = Ho, Dy, Gd, Eu) complex perovskites

International Nuclear Information System (INIS)

Triana, C.A.; Landínez Téllez, D.A.; Roa-Rojas, J.

2013-01-01

Sr 2 HrRuO 6 (Hr = Ho, Dy, Gd, Eu) complex perovskites were synthesized through the high-temperature solid-state reaction method, and their crystal structures were analyzed in detail as a function of the Hr-cation ionic radius. Results of powder XRD pattern measurement and Rietveld analysis of the experimental profiles show that the Sr 2 HrRuO 6 compounds crystallize in a monoclinic distorted perovskite-like structure, P2 1 /n (#14) space group, where the unit cell parameters are related to the primitive unit cell a p by a≈√(2)a p , b≈√(2)a p and c ≈ 2a p . The structures show an alternate distribution of the Ru 5+ (2d: 0.5, 0, 0) and Hr 3+ (2c: 0, 0.5, 0) making up RuO 6 and HrO 6 octahedra alternatively arranged in two interleaving fcc sublattices, where the O(1), O(2), and O(3) ions are localized at the corner of the octahedral, while the Sr 2+ is located at the A-site, occupying the cavities built by the corner-sharing octahedra with Wyckoff position 4e. Due to the existence of mismatched ionic sizes between the ionic radii of the Sr 2 HrRuO 6 compounds, the HrO 6 and RuO 6 octahedra are constrained to tilting around the [111] c , [001] c , and [110] c cubic directions so as to optimize the Sr–O inter-atomic bond lengths, tending to rotate the structure in order to fix the Ru 5+ and Hr 3+ ions on the M′ and M″ sites of the complex perovskites. The cell parameters a, b, and c, the inter-atomic bond angles, the inter-atomic bond lengths, and the tilting angles increase as the Hr-cation ionic radius increases. The mismatch that exists in the Sr 2 HrRuO 6 ionic radius produces a large distortion from the ideal cubic symmetry. The pure perovskite-like phase of Sr 2 HrRuO 6 is thermodynamically and kinetically stable at high temperatures above 1420 K, where it is entirely governed by the average size of the Hr 3+ and Ru 5+ cations. Highlights: ► Crystal structure of Sr 2 HrRuO 6 (Hr = Ho, Dy, Gd, Eu) as a function of Hr ionic radius. ► XRD

AuRu/meso-Mn2O3: A Highly Active and Stable Catalyst for Methane Combustion

Science.gov (United States)

Han, Z.; Fang, J. Y.; Xie, S. H.; Deng, J. G.; Liu, Y. X.; Dai, H. X.

2018-05-01

Three-dimensionally ordered mesoporous Mn2O3 (meso-Mn2O3) and its supported Au, Ru, and AuRu alloy (0.49 wt% Au/meso-Mn2O3, 0.48 wt% Ru/meso-Mn2O3, and 0.97 wt% AuRu/meso-Mn2O3 (Au/Ru molar ratio = 0.98)) nanocatalysts were prepared using the KIT-6-templating and polyvinyl alcohol-protected reduction methods, respectively. Physicochemical properties of the samples were characterized by means of numerous techniques, and their catalytic activities were evaluated for the combustion of methane. It is found that among all of the samples, 0.48 wt% Ru/meso-Mn 2O3 and 0.97 wt% AuRu/meso-Mn2O3 performed the best (the reaction temperature (T90% ) at 90% methane conversion was 530-540°C), but the latter showed a better thermal stability than the former. The partial deactivation of 0.97 wt% AuRu/meso-Mn2O3 due to H2O or CO2 introduction was reversible. It is concluded that the good catalytic activity and thermal stability of 0.97 wt% AuRu/meso-Mn2O3 was associated with the high dispersion of AuRu alloy NPs (2-5 nm) on the surface of meso-Mn2O3 and good low-temperature reducibility.

Electronic structures of three semiconducting intermetallics: RuAl sub 2 , RuGa sub 2 and OsAl sub 2

CERN Document Server

Springborg, M

1998-01-01

Results of first-principles, density-functional, LMTO-ASA calculations on the closely related C11, C40, and C54 structures of the three title compounds are reported. Only for OsAl sub 2 in the C11 structure were the structural degrees of freedom optimized; this gave results in good agreement with experimental values. On the other hand, the calculations were not capable of reproducing the correct relative stability of the different structures; this was ascribed to the atomic-sphere approximation. All of the compounds were found to be small-gap semiconductors with, however, a slightly larger gap for OsAl sub 2. The occurrence of a gap at the Fermi level is mainly due to hybridization between d functions of Os or Ru and p functions of Al or Ga, but, in particular for OsAl sub 2 , charge-transfer effects can also be considered to be responsible for the occurrence of a gap. Several flat bands just above the Fermi level lead to a corresponding high density of states there, but also to low carrier velocities. As a b...

Ground state properties and thermoelectric behavior of Ru{sub 2}VZ (Z=Si, ge, sn) half-metallic ferromagnetic full-Heusler compounds

Energy Technology Data Exchange (ETDEWEB)

Yalcin, Battal Gazi

2016-06-15

The ground state properties namely structural, mechanical, electronic and magnetic properties and thermoelectric behavior of Ru{sub 2}VZ (Z=Si, Ge and Sn) half-metallic ferromagnetic full-Heusler compounds are systematically investigated. These compounds are ferromagnetic and crystallize in the Heusler type L2{sub 1} structure (prototype: Cu{sub 2}MnAl, Fm-3m 225). This result is confirmed for Ru{sub 2}VSi and Ru{sub 2}VSn by experimental work reported by Yin and Nash using high temperature direct reaction calorimetry. The studied materials are half-metallic ferromagnets with a narrow direct band gap in the minority spin channel that amounts to 31 meV, 66 meV and 14 meV for Ru{sub 2}VSi, Ru{sub 2}VGe, and Ru{sub 2}VSn, respectively. The total spin magnetic moment (M{sub tot}) of the considered compounds satisfies a Slater–Pauling type rule for localized magnetic moment systems (M{sub tot}=(N{sub V}−24)µ{sub B}), where N{sub V}=25 is the number of valence electrons in the primitive cell. The Curie temperature within the random phase approximation (RPA) is found to be 23 K, 126 K and 447 K for Ru{sub 2}VSi, Ru{sub 2}VGe and Ru{sub 2}VSn, respectively. Semi-classical Boltzmann transport theories have been used to obtain thermoelectric constants, such as Seebeck coefficient (S), electrical (σ/τ) and thermal conductivity (κ/τ), power factor (PF) and the Pauli magnetic susceptibility (χ). ZT{sub MAX} values of 0.016 (350 K), 0.033 (380 K) and 0.063 (315 K) are achieved for Ru{sub 2}VSi, Ru{sub 2}VGe and Ru{sub 2}VSn, respectively. It is expected that the obtained results might be a trigger in future experimentally interest in this type of full-Heusler compounds. - Graphical abstract: Temperature dependence of figure of merit for Ru{sub 2}VZ (Z=Si, Ge, and Sn) compounds. - Highlights: • The ground state and thermoelectric properties are reported for the first time. • Ru{sub 2}VZ are found to be a half-metallic ferromagnetic full Heusler compound. • The

Magnetic, electrical and structural properties of the Re-doped ruthenocuprate Ru1−xRexSr2GdCu2Oy

International Nuclear Information System (INIS)

Corredor, L.T.; Albino Aguiar, J.; Landínez Téllez, D.A.; Pureur, P.; Mesquita, F.; Roa-Rojas, J.

2015-01-01

Highlights: • We investigated the effect of the dilution of magnetic Ru sub-lattice of RuSr 2 GdCu 2 O 8 . • We synthesized the doped compound Rui x Re x Sr 2 GdCu 2 O y , for 3%, 6%, 9% and 12% Re. • Re would affect the electron coupling: just 3 and 6% samples were superconductor. • Superconductivity emergence strongly affects magnetic properties of 3 and 6% samples. • A weak ferromagnetic component is consistent with a globally antiferromagnetic system. - Abstract: Despite the discovery of new superconductors classes, high-Tc oxides continue to be a current topic, because of their complex phase diagrams and doping-dependant effects (allowing one to investigate the interaction between orbitals), as well as structural properties such as lattice distortion and charge ordering, among many others. Ruthenocuprates are magnetic superconductors in which the magnetic transition temperature is much higher than the critical superconducting temperature, making them unique compounds. With the aim of investigating the dilution of the magnetic Ru sub-lattice, we proposed the synthesis of the Ru 1−x Re x Sr 2 GdCu 2 O y ruthenocuprate-type family, adapting the known two-step process (double perovskite + CuO) by directly doping the double perovskite, thus obtaining the perovskite compound Sr 2 GdRu 1−x Re x O y , which represents a new synthesis process to the best of our knowledge. Our samples were structurally characterized through X-ray diffraction, and the patterns were analysed via Rietveld refinement. A complete magnetic characterization as a function of temperature and applied field, as well as transport measurements were carried out. We discuss our results in the light of the two-lattice model for ruthenocuprates, and a relation between RuO 2 (magnetic) and CuO 2 (superconductor) sub-lattices can clearly be observed

FeRu/TiO2 and Fe/TiO2 catalysts after reduction and Fischer-Tropsch synthesis studied by Moessbauer spectroscopy

International Nuclear Information System (INIS)

Kraan, A.M. van der; Nonnekens, R.C.H.; Niemantsverdriet, J.W.

1986-01-01

A series of TiO 2 -supported bimetallic FeRu catalysts with different Fe:Ru ratios (infinity; 10:1; 3:1; 1:1; 1:3) has been studied by means of in situ Moessbauer spectroscopy. The influence of reduction and Fischer-Tropsch synthesis on the state of iron in the FeRu/TiO 2 catalysts is derived. (Auth.)

Electrochemical Reduction of CO2 on IrxRu(1–x)O2(110) Surfaces 

DEFF Research Database (Denmark)

Bhowmik, Arghya; Hansen, Heine Anton; Vegge, Tejs

2017-01-01

with oxygen-coordinated intermediates that can circumvent the limitations imposed by the scaling relations on metal catalysts. Here, we introduce an innovative concept of ligand effects in oxide catalysts. Both IrO2 and RuO2 binds OH* and other intermediates from the electrochemical reduction of CO2 (CO2RR......High overpotentials and low faradic efficiencies plague metal catalysts for direct conversion of CO2 to methanol and other liquid fuels. RuO2-based electrocatalysts have been observed to evolve methanol at low overpotentials, which has been attributed to an alternative reaction mechanism......) strongly, but the stable and miscible system IrxRu(1-x)O2 exhibits anomalous weaker binding energy in the presence of CO* spectators, because of Ru–Ir ligand effects. The weakened adsorbate binding leads to a very low CO2RR onset potential (methanol evolution at −0.2 V RHE). An Ir atom at the bridge site...

Fermi surfaces of YRu2Si2 and LaRu2Si2

International Nuclear Information System (INIS)

Settai, R.; Ikezawa, H.; Toshima, H.; Takashita, M.; Ebihara, T.; Sugawara, H.; Kimura, T.; Motoki, K.; Onuki, Y.

1995-01-01

We have measured the de Haas-van Alphen effect of YRu 2 Si 2 and LaRu 2 Si 2 to clarify the Fermi surfaces and cyclotron masses. Main hole-Fermi surfaces of both compounds with a distorted ellipsoid shape are similar, occupying about half of the Brillouin zone. The small hole-Fermi surfaces with the shape of a rugby ball are three in number for LaRu 2 Si 2 , and one for YRu 2 Si 2 . An electron-Fermi surface consists of a doughnut like shape for LaRu 2 Si 2 , while a cylinder along the [001] direction and a multiply-connected shape exist for YRu 2 Si 2 . The cyclotron masses of YRu 2 Si 2 are a little larger than those of LaRu 2 Si 2 . ((orig.))

Enhanced photocatalytic CO2 reduction to CH4 over separated dual co-catalysts Au and RuO2

Science.gov (United States)

Dong, Chunyang; Hu, Songchang; Xing, Mingyang; Zhang, Jinlong

2018-04-01

A spatially separated, dual co-catalyst photocatalytic system was constructed by the stepwise introduction of RuO2 and Au nanoparticles (NPs) at the internal and external surfaces of a three dimensional, hierarchically ordered TiO2-SiO2 (HTSO) framework (the final photocatalyst was denoted as Au/HRTSO). Characterization by HR-TEM, EDS-mapping, XRD and XPS confirmed the existence and spatially separated locations of Au and RuO2. In CO2 photocatalytic reduction (CO2PR), Au/HRTSO (0.8%) shows the optimal performance in both the activity and selectivity towards CH4; the CH4 yield is almost twice that of the singular Au/HTSO or HRTSO (0.8%, weight percentage of RuO2) counterparts. Generally, Au NPs at the external surface act as electron trapping agents and RuO2 NPs at the inner surface act as hole collectors. This advanced spatial configuration could promote charge separation and transfer efficiency, leading to enhanced CO2PR performance in both the yield and selectivity toward CH4 under simulated solar light irradiation.

Influence of Binders and Solvents on Stability of Ru/RuOx Nanoparticles on ITO Nanocrystals as Li-O2 Battery Cathodes.

Science.gov (United States)

Vankova, Svetoslava; Francia, Carlotta; Amici, Julia; Zeng, Juqin; Bodoardo, Silvia; Penazzi, Nerino; Collins, Gillian; Geaney, Hugh; O'Dwyer, Colm

2017-02-08

Fundamental research on Li-O 2 batteries remains critical, and the nature of the reactions and stability are paramount for realising the promise of the Li-O 2 system. We report that indium tin oxide (ITO) nanocrystals with supported 1-2 nm oxygen evolution reaction (OER) catalyst Ru/RuO x nanoparticles (NPs) demonstrate efficient OER processes, reduce the recharge overpotential of the cell significantly and maintain catalytic activity to promote a consistent cycling discharge potential in Li-O 2 cells even when the ITO support nanocrystals deteriorate from the very first cycle. The Ru/RuO x nanoparticles lower the charge overpotential compared with those for ITO and carbon-only cathodes and have the greatest effect in DMSO electrolytes with a solution-processable F-free carboxymethyl cellulose (CMC) binder (ITO nanocrystalline materials in DMSO provide efficient Li 2 O 2 decomposition from within the cathode during cycling. We demonstrate that the ITO is actually unstable from the first cycle and is modified by chemical etching, but the Ru/RuO x NPs remain effective OER catalysts for Li 2 O 2 during cycling. The CMC binders avoid PVDF-based side-reactions and improve the cyclability. The deterioration of the ITO nanocrystals is mitigated significantly in cathodes with a CMC binder, and the cells show good cycle life. In mixed DMSO-EMITFSI [EMITFSI=1-ethyl-3-methylimidazolium bis(trifluoromethylsulfonyl)imide] ionic liquid electrolytes, the Ru/RuO x /ITO materials in Li-O 2 cells cycle very well and maintain a consistently very low charge overpotential of 0.5-0.8 V. © 2017 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

Ab-initio calculations of electric field gradient in Ru compounds and ...

Indian Academy of Sciences (India)

Home; Journals; Pramana – Journal of Physics; Volume 89; Issue 2. A b − i n i t i o calculations of electric field gradient in Ru compounds and their implication on the nuclear quadrupole moments of 99 Ru and 101 Ru. S N MISHRA. Research Article Volume 89 Issue 2 August 2017 Article ID 22 ...

Production of 34S-labeled gypsum (Ca34SO4.2H2O Produção de gesso (Ca34SO4.2H2O, marcado com 34S

Directory of Open Access Journals (Sweden)

Alexssandra Luiza Rodrigues Molina Rossete

2006-08-01

Full Text Available Agricultural gypsum (CaSO4.2H2O stands out as an effective source of calcium and sulfur, and to control aluminum saturation in the soil. Labeled as 34S it can elucidate important aspects of the sulfur cycle. Ca34SO4.2H2O was obtained by chemical reaction between Ca(OH2 and H2(34SO4, performed under slow agitation. The acid was produced by ion exchange chromatography using the Dowex 50WX8 cation exchange resin and a Na2(34SO4 eluting solution. After precipitation, the precipitate was separated and dried in a ventilated oven at 60ºC. From 2.2 L H2SO4 0.2 mol L-1 and 33.6 g Ca(OH2, 73.7 ± 0.6 g Ca34SO4.2H2O were produced on average in the tests, representing a mean yield of 94.6 ± 0.8%, with 98% purity. The 34SO2 gas was obtained from Ca34SO4.2H2O in the presence of NaPO3 in a high vacuum line and was used for the isotopic determination of S in an ATLAS-MAT model CH-4 mass spectrometer.O gesso agrícola (CaSO4.2H2O destaca-se como fonte eficiente de cálcio e enxofre e na redução da saturação de alumínio no solo. O 34S como traçador isotópico pode elucidar aspectos importantes no ciclo do enxofre. Para tanto o Ca34SO4.2H2O foi obtido por reação química entre o Ca(OH2 e solução de H2(34SO4, realizada sob agitação lenta. O ácido foi produzido por cromatografia de troca iônica, utilizando resina catiônica Dowex 50WX8 e solução eluente de Na2(34SO4. Após a precipitação foi separado o precipitado e realizada a secagem em estufa ventilada à temperatura de 60ºC. Nos testes, a partir de 2,2 L de H2SO4 0,2 mol L-1 e 33,6 g de Ca(OH2, foram produzidos em média 73,7 ± 0,6 g de Ca34SO4.2H2O representando um rendimento médio de 94,6 ± 0,8%, com pureza de 98%. A partir do Ca34SO4.2H2O na presença de NaPO3, em linha de alto vácuo, obteve-se o gás 34SO2 utilizado para a determinação isotópica do S no espectrômetro de massas ATLAS-MAT modelo CH-4.

Characterization of an innovative method for RuO2 deposition using Electron Microscopy

DEFF Research Database (Denmark)

Cavalca, Filippo

Many photocatalysts work better or exclusively when a suitable cocatalyst, such as RuO2, is deposited on their surface. An innovative method of RuO2 deposition has been found to improve the performance of photocatalysts such as (Ga1-xZnx)(N1-xOx), WO3, SrTiO3 and TiO2. Here we use high angle annu...

Electrocatalytical activity of Pt, SnO2 and RuO2 mixed electrodes for the electrooxidation of formic acid and formaldehyde

International Nuclear Information System (INIS)

Profeti, L.P.R.; Profeti, D.; Olivi, P.

2005-01-01

The electrocatalytical activity of binary electrodes of Pt and SnO 2 and ternary electrodes of Pt and SnO 2 and RuO 2 for the electrooxidation of formic acid and formaldehyde was investigated by cyclic voltammetry and chronoamperometry techniques. The electrode materials were prepared by the thermal decomposition of polymeric precursors at 400 deg C. The cyclic voltammetry results showed that the methanol electrooxidation process presents peak potentials for those electrodes approximately 100 mV lower than the values obtained for metallic platinum electrodes. The Pt 0.6 Ru 0.2 Sn 0.2 O y electrodes presented the highest current density values for potentials lower than the peak potential values. The chronoamperometric experiments also showed that the addition of SnO 2 and RuO 2 contributed for the enhancement of the electrode activity in low potential values. The preparation method was found to be useful to obtain high active materials. (author)

Thermal response of Ru electrodes in contact with SiO2 and Hf-based high-k gate dielectrics

International Nuclear Information System (INIS)

Wen, H.-C.; Lysaght, P.; Alshareef, H.N.; Huffman, C.; Harris, H.R.; Choi, K.; Senzaki, Y.; Luan, H.; Majhi, P.; Lee, B.H.; Campin, M. J.; Foran, B.; Lian, G.D.; Kwong, D.-L.

2005-01-01

A systematic experimental evaluation of the thermal stability of Ru metal gate electrodes in direct contact with SiO 2 and Hf-based dielectric layers was performed and correlated with electrical device measurements. The distinctly different interfacial reactions in the Ru/SiO 2 , Ru/HfO 2 , and Ru/HfSiO x film systems were observed through cross-sectional high-resolution transmission electron microscopy, high angle annular dark field scanning transmission electron microscopy with electron-energy-loss spectra, and energy dispersive x-ray spectra analysis. Ru interacted with SiO 2 , but remained stable on HfO 2 at 1000 deg. C. The onset of Ru/SiO 2 interfacial interactions is identified via silicon substrate pitting possibly from Ru diffusion into the dielectric in samples exposed to a 900 deg. C/10-s anneal. The dependence of capacitor device degradation with decreasing SiO 2 thickness suggests Ru diffuses through SiO 2 , followed by an abrupt, rapid, nonuniform interaction of ruthenium silicide as Ru contacts the Si substrate. Local interdiffusion detected on Ru/HfSiO x samples may be due to phase separation of HfSiO x into HfO 2 grains within a SiO 2 matrix, suggesting that SiO 2 provides a diffusion pathway for Ru. Detailed evidence consistent with a dual reaction mechanism for the Ru/SiO 2 system at 1000 deg. C is presented

Adsorption of water on O(2x2)/Ru(0001): thermal stability and inhibition of dissociation by H2O-O bonding

Energy Technology Data Exchange (ETDEWEB)

Mugarza, Aitor; Shimizu, Tomoko; Cabrera-Sanfelix, Pepa; Sanchez-Portal, Daniel; Arnau, Andres; Salmeron, Miquel

2008-08-01

The effect of preadsorbed oxygen on the subsequent adsorption and reactions of water on Ru(0001) has been studied using low temperature scanning tunneling microscopy and DFT calculations. Experiments were carried out for O coverages close to 0.25 ML. It was found that no dissociation of water takes place up to the desorption temperature of {approx}180-230 K. DFT calculations show that intact water on O(2x2)/Ru(0001) is {approx} 0.49 eV more stable than the dissociation products, H and OH, at their preferred fcc and top adsorption sites.

Between Localization and Delocalization: Ru(cod)2+ Units in the Zintl Clusters [Bi9 {Ru(cod)}2 ]3- and [Tl2 Bi6 {Ru(cod)}]2.

Science.gov (United States)

Lichtenberger, Niels; Spang, Nils; Eichhöfer, Andreas; Dehnen, Stefanie

2017-10-16

Reactions of [K(crypt-222)] 2 (TlBi 3 )⋅0.5 en (1 b) with [Ru(cod)(H 2 CC(Me)CH 2 ) 2 ] (A) in 1,2-diaminoethane (en) led to the formation of two compounds with new bismuth-rich cluster anions, [K(crypt-222)] 3 [Bi 9 {Ru(cod)} 2 ]⋅1.5 en (2) and [K(crypt-222)] 2 [Tl 2 Bi 6 {Ru(cod)}]⋅2 tol (3), alongside the salt of a binary nido cluster, [K(crypt-222)] 3 (Tl 4 Bi 5 )⋅2 en (4). The anions in 2 and 3 are two further examples of rare heterometallic clusters containing Ru atoms. As one cod ligand is retained on each Ru atom in both clusters, the anions may be viewed as intermediates on the way towards larger, ligand-free intermetalloid clusters. Quantum-chemical studies provided insight into the bonding situation in these clusters. According to these studies, the anion of 2 features both electron-precise and electron-deficient parts. Electrospray ionization mass spectrometry analysis indicated that the clusters undergo stepwise fragmentation. © 2017 Wiley-VCH Verlag GmbH & Co. KGaA, Weinheim.

Endosomes: guardians against [Ru(Phen)3]2+ photo-action in endothelial cells during in vivo pO2 detection?

Science.gov (United States)

Huntosova, Veronika; Stroffekova, Katarina; Wagnieres, Georges; Novotova, Marta; Nichtova, Zuzana; Miskovsky, Pavol

2014-12-01

Phototoxicity is a side-effect of in vitro and in vivo oxygen partial pressure (pO2) detection by luminescence lifetime measurement methods. Dichlorotris(1,10-phenanthroline)-ruthenium(ii) hydrate ([Ru(Phen)3]2+) is a water soluble pO2 probe associated with low phototoxicity, which we investigated in vivo in the chick's chorioallantoic membrane (CAM) after intravenous or topical administration and in vitro in normal human coronary artery endothelial cells (HCAEC). In vivo, the level of intravenously injected [Ru(Phen)3]2+ decreases within several minutes, whereas the maximum of its biodistribution is observed during the first 2 h after topical application. Both routes are followed by convergence to almost identical "intra/extra-vascular" levels of [Ru(Phen)3]2+. In vitro, we observed that [Ru(Phen)3]2+ enters cells via endocytosis and is then redistributed. None of the studied conditions induced modification of lysosomal or mitochondrial membranes without illumination. No nuclear accumulation was observed. Without illumination [Ru(Phen)3]2+ induces changes in endoplasmic reticulum (ER)-to-Golgi transport. The phototoxic effect of [Ru(Phen)3]2+ leads to more marked ultrastructural changes than administration of [Ru(Phen)3]2+ only (in the dark). These could lead to disruption of Ca2+ homeostasis accompanied by mitochondrial changes or to changes in secretory pathways. In conclusion, we have demonstrated that the intravenous injection of [Ru(Phen)3]2+ into the CAM model mostly leads to extracellular localization of [Ru(Phen)3]2+, while its topical application induces intracellular localization. We have shown in vivo that [Ru(Phen)3]2+ induces minimal photo-damage after illumination with light doses larger by two orders of magnitude than those used for pO2 measurements. This low phototoxicity is due to the fact that [Ru(Phen)3]2+ enters endothelial cells via endocytosis and is then redistributed towards peroxisomes and other endosomal and secretory vesicles before it

Hydrogen-promoted chlorination of RuO2(110)

NARCIS (Netherlands)

Hofmann, J.P.; Zweidinger, S.; Knapp, M.; Seitsonen, A.P.; Schulte, K.; Andersen, J.N.; Lundgren, E.; Over, H.

2010-01-01

High-resolution core-level photoemission spectroscopy and temperature-programmed reaction experiments together with density functional theory calculations were used to elucidate on the atomic scale the chlorination mechanism of ruthenium dioxide RuO2(110) by hydrogen chloride exposure. The

Mixed valent noble metal perovskites Ba/sub 3/B/sup 3 +/Pt/sub x/Ru/sub 2-x//sup 4. 5+/O/sub 9/

Energy Technology Data Exchange (ETDEWEB)

Moessner, B; Kemmler-Sack, S; Ehmann, A [Tuebingen Univ. (Germany, F.R.). Lehrstuhl fuer Anorganische Chemie 2

1982-04-01

In perovskites of type Ba/sub 3/B/sup 3 +/Pt/sub x/Ru/sub 2-x//sup 4.5+/O/sub 9/ the ruthenium can be substituted by platinum up to x = 1. The compounds crystallize in a 1:2 ordered hexagonal BaTiO/sub 3/ structure (sequence (hcc)/sub 2/) with face connected Pt/sub x/Ru/sub 2-x/O/sub 9/ double octahedra. Intensity calculations on powder data of Ba/sub 3/YPt/sub 1/2/Ru/sub 3/2/O/sub 9/ (space group P6/sub 3//mmc) gave a refined, intensity related R' value of 8.6%. The vibrational spectroscopic and catalytic properties are reported.

The Importance of Surface IrO_x in Stabilizing RuO₂ for Oxygen Evolution

DEFF Research Database (Denmark)

Escribano, Maria Escudero; Pedersen, Anders Filsøe; Paoli, Elisa Antares

2018-01-01

consisting of RuO2 thin films with sub-monolayer (1, 2 and 4 Å) amounts of IrOx deposited on top. Operando extended X-ray absorption fine structure (EXAFS) on the Ir L-3 edge revealed a rutile type IrO2 structure with some Ir sites occupied by Ru, IrOx being at the surface of the RuO2 thin film. We monitor...... corrosion on IrOx/RuO2 thin films by combining electrochemical quartz crystal microbalance (EQCM) with inductively coupled mass spectrometry (ICP-MS). We elucidate the importance of sub-monolayer surface IrOx in minimizing Ru dissolution. Our work shows that we can tune the surface properties of active OER...

Towards identifying the active sites on RuO2(110) in catalyzing oxygen evolution  

DEFF Research Database (Denmark)

Rao, Reshma R.; Kolb, Manuel J.; Halck, Niels Bendtsen

2017-01-01

While the surface atomic structure of RuO2 has been well studied in ultra high vacuum, much less is known about the interaction between water and RuO2 in aqueous solution. In this work, in situ surface X-ray scattering measurements combined with density functional theory (DFT) were used to determ......While the surface atomic structure of RuO2 has been well studied in ultra high vacuum, much less is known about the interaction between water and RuO2 in aqueous solution. In this work, in situ surface X-ray scattering measurements combined with density functional theory (DFT) were used...... on the coordinatively unsaturated Ru sites (CUS) and hydrogen adsorbed to the bridging oxygen sites. At potentials relevant to the oxygen evolution reaction (OER), an –OO species on the Ru CUS sites was detected, which was stabilized by a neighboring –OH group on the Ru CUS or bridge site. Combining potential...

Peierls-distorted Ru-chains and boron dumbbells in Nb{sub 2}RuB{sub 2} and Ta{sub 2}RuB{sub 2} from first-principles calculations and experiments

Energy Technology Data Exchange (ETDEWEB)

Touzani, Rachid S.; Mbarki, Mohammed; Chen, Ximeng [Institute of Inorganic Chemistry, RWTH Aachen University (Germany); Fokwa, Boniface P.T. [Institute of Inorganic Chemistry, RWTH Aachen University (Germany); Department of Chemistry, University of California Riverside (UCR), Riverside, CA (United States)

2016-09-15

Nb{sub 2}RuB{sub 2} and Ta{sub 2}RuB{sub 2} phases were recently predicted by GGA-VASP structure optimization to crystallize in the Nb{sub 2}OsB{sub 2}-type structure. Although the Fe-based (Mo{sub 2}FeB{sub 2} type) and Os-based (Nb{sub 2}OsB{sub 2} type, superstructure variant of Mo{sub 2}FeB{sub 2} type) analogues have been synthesized and characterized successfully, the Ru-based phases remained unknown. Crystal structure prediction of Nb{sub 2}RuB{sub 2} and Ta{sub 2}RuB{sub 2} phases, using an evolutionary algorithm, led to the AlMn{sub 2}B{sub 2}-type structure in contrast to the aforementioned optimization; however, phonon calculations showed that the Nb{sub 2}OsB{sub 2}-type phases are dynamically more stable than the AlMn{sub 2}B{sub 2}-type phases. A slightly modified synthetic strategy finally led to the successful preparation of the predicted phases. The extremely quick arc-melting procedure, under argon atmosphere, not only led to a quantitative amount of the phases but also to single crystals suitable for structure determination. Powder and single-crystal X-ray diffraction as well as EDX analysis of the metal ratio have confirmed the GGA-VASP structure optimization: Nb{sub 2}RuB{sub 2} and Ta{sub 2}RuB{sub 2} compounds indeed crystallize isotypically with Nb{sub 2}OsB{sub 2} structure, a superstructure variant of Mo{sub 2}FeB{sub 2} type, in which B-dumbbells and Peierls-distorted Ru-chains are found. Susceptibility measurements on a Ta{sub 2}RuB{sub 2} single crystal reveal no superconducting transition down to 2 K, even though some features in the band structures of both phases, similar to those reported in superconducting NbRuB, hinted at possible superconductivity. (copyright 2016 WILEY-VCH Verlag GmbH and Co. KGaA, Weinheim)

Crystal structures of bromo- and iododerivatives of ruthenium nitroso complexes K2[RuNOX5

International Nuclear Information System (INIS)

Mikhajlov, Yu.N.; Kanishcheva, A.S.; Svetlov, A.A.

1989-01-01

Method of X-ray diffraction analysis was used to interpret crystal structure of ruthenium pentahalogenonitroso complexes: K 2 [RuNOBr 5 ] (1) and K 2 [RuOI 5 ] (2). Crystals belong to rhombic syngony, sp.gr. Pcmn. Lattice parameters: (1) - a 7.236(2), b = 10.791(2), c = 13.949(3) A, V = 1089.14(1) A 3 , Z = 4; (2) - a = 7.755(1), b = 11.506(6), c = 14.951(5) A, V 133.97(8) A 3 , Z = 4. It was revealed that lengths of Ru-Br equatorial bonds in (1) exceeded the axial ones, and in the compound (2) the reverse relation was observed. The obtained results were correlated with the structural data for K 2 [RuNOF 5 ]H 2 O and K 2 [RuNOCl 5 ] complexes and similar osmium compounds

Carbon-free H2 production from ammonia triggered at room temperature with an acidic RuO2/γ-Al2O3 catalyst.

Science.gov (United States)

Nagaoka, Katsutoshi; Eboshi, Takaaki; Takeishi, Yuma; Tasaki, Ryo; Honda, Kyoko; Imamura, Kazuya; Sato, Katsutoshi

2017-04-01

Ammonia has been suggested as a carbon-free hydrogen source, but a convenient method for producing hydrogen from ammonia with rapid initiation has not been developed. Ideally, this method would require no external energy input. We demonstrate hydrogen production by exposing ammonia and O 2 at room temperature to an acidic RuO 2 /γ-Al 2 O 3 catalyst. Because adsorption of ammonia onto the catalyst is exothermic, the catalyst bed is rapidly heated to the catalytic ammonia autoignition temperature, and subsequent oxidative decomposition of ammonia produces hydrogen. A differential calorimeter combined with a volumetric gas adsorption analyzer revealed a large quantity of heat evolved both with chemisorption of ammonia onto RuO 2 and acidic sites on the γ-Al 2 O 3 and with physisorption of multiple ammonia molecules.

Anodic composite deposition of RuO2/reduced graphene oxide/carbon nanotube for advanced supercapacitors

Science.gov (United States)

Hu, Chi-Chang; Wang, Chia-Wei; Chang, Kuo-Hsin; Chen, Ming-Guan

2015-07-01

Anodic composite deposition is demonstrated to be a unique method for fabricating a ternary ruthenium dioxide/reduced graphene oxide/carbon nanotube (RuO2 · xH2O/rGO/CNT, denoted as RGC) nanocomposite onto Ti as an advanced electrode material for supercapacitors. The rGO/CNT composite in RGCs acts as a conductive backbone to facilitate the electron transport between current collector and RuO2 · xH2O nanoparticles (NPs), revealed by the high total specific capacitance (CS,T = 808 F g-1) of RGC without annealing. The contact resistance among RuO2 · xH2O NPs is improved by low-temperature annealing at 150 °C (RGC-150), which renders slight sintering and enhances the specific capacitance of RuO2 · xH2O to achieve 1200 F g-1. The desirable nanocomposite microstructure of RGC-150 builds up the smooth pathways of both protons and electrons to access the active oxy-ruthenium species. This nanocomposite exhibits an extremely high CS,T of 973 F g-1 at 25 mV s-1 (much higher than 435 F g-1 of an annealed RuO2 · xH2O deposit) and good capacitance retention (60.5% with scan rate varying from 5 to 500 mV s-1), revealing an advanced electrode material for high-performance supercapacitors.

The abatement of indigo carmine using active chlorine electrogenerated on ternary Sb2O5-doped Ti/RuO2-ZrO2 anodes in a filter-press FM01-LC reactor

International Nuclear Information System (INIS)

Palma-Goyes, R.E.; Vazquez-Arenas, J.; Torres-Palma, R.A.; Ostos, C.; Ferraro, F.; González, I.

2015-01-01

Dimensionally Stable Anodes (DSA) of Sb 2 O 5 -doped Ti/RuO 2 -ZrO 2 are prepared by the Pechini method to perform the degradation of indigo carmine (IC) under conditions similar to textile wastewater effluents. XRD results along with Rietveld refinement reveal that the co-deposited phases on the DSA exhibit a tetragonal crystal structure (P4/mmm) for RuO 2 and monoclinic structure (P2/m) for ZrO 2 . Degradation tests conducted in solutions containing 0.64 mM IC and 0.05 M NaCl using a filter-press reactor (FM01-LC) show that the degradation rate is faster and more efficient at 200 A m −2 with a flow rate of 5 L min −1 , although the energy consumption is moderately higher. Under this condition, the pollutant is efficiently removed, and converted to aliphatic acid compounds of low molecular weight, as indicated by 90 % Chemical Oxygen Demand (COD), 22 % Total Organic Carbon (TOC) elimination, along with an Average Oxidation State (AOS) value equal to 3.0. The energy consumptions revealed that it is feasible to carry out the IC degradation under reasonable operating costs. Topological and Natural Bond Orbital (NBO) analyses are computed using density functional theory (DFT), and combined with experimental results to propose a reaction pathway for IC abatement

The growth and characterization of well aligned RuO2 nanorods on sapphire substrates

International Nuclear Information System (INIS)

Chen, C C; Chen, R S; Tsai, T Y; Huang, Y S; Tsai, D S; Tiong, K K

2004-01-01

Self-assembled and well aligned RuO 2 nanorods (NRs) have been grown on sapphire (SA) substrates via metal-organic chemical vapour deposition (MOCVD), using bis(ethylcyclopentadienyl)ruthenium as the source reagent. The surface morphology, structural, and spectroscopic properties of the as-deposited NRs were characterized using field-emission scanning electron microscopy (FESEM), transmission electron microscopy (TEM), selected-area electron diffractometry (SAD), x-ray diffraction (XRD), x-ray photoelectron spectroscopy (XPS), and micro-Raman spectroscopy. FESEM micrographs reveal that vertically aligned nanorods (NRs) were grown on SA(100), while the NRs on the SA(012) were grown with a tilt angle of ∼ 35 degrees from the normal to the substrates. TEM and SAD measurements showed that the RuO 2 NRs with square cross-section have the long axis directed along the [001] direction. The XRD results indicate that the RuO 2 NRs are (002) oriented on SA(100) and (101) oriented on SA(012) substrates. A strong substrate effect on the alignment of the RuO 2 NRs growth has been demonstrated and the probable mechanism for the formation of these NRs has been discussed. XP spectra show the coexistence of higher oxidation state of ruthenium in the as-grown RuO 2 NRs. Micro-Raman spectra show the red-shift and peak broadening of the RuO 2 signatures with respect to that of the bulk counterpart which may be indicative of a phonon confinement effect for these NRs

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

Electronic and elastic properties of new semiconducting oP{sub 12}-type RuB{sub 2} and OsB{sub 2}

Energy Technology Data Exchange (ETDEWEB)

Hao Xianfeng; Xu Yuanhui; Gao Faming, E-mail: xfhao1980@yahoo.com.cn [Key Laboratory of Applied Chemistry, Yanshan University, Qinhuangdao 066004 (China)

2011-03-30

Using first-principles total energy calculations we investigate the structural, elastic and electronic properties of new hypothetical oP{sub 12}-type phase RuB{sub 2} and OsB{sub 2}. The calculations indicate that the oP{sub 12}-type phase RuB{sub 2} and OsB{sub 2} are thermodynamically and mechanically stable. Remarkably, the new phases RuB{sub 2} and OsB{sub 2} are predicted to be semiconductors, and the appearance of band gaps is ascribed to the enhanced B-B covalent hybridization. Compared to metallic oP{sub 6}-type RuB{sub 2} and OsB{sub 2} phases, the new phases possess similar mechanical properties and hardness. The combination of the probability of tunable electronic properties, strong stiffness and high hardness make RuB{sub 2} and OsB{sub 2} attractive and interesting for advanced applications.

Rotational and translational distortions of the crystal structure of the Sr{sub 2}HrRuO{sub 6} (Hr = Ho, Dy, Gd, Eu) complex perovskites

Energy Technology Data Exchange (ETDEWEB)

Triana, C.A., E-mail: ctrianae@unal.edu.co [Grupo de Física de Nuevos Materiales, Departamento de Física, Universidad Nacional de Colombia, A.A. 5997, Bogotá D.C. (Colombia); Landínez Téllez, D.A. [Grupo de Física de Nuevos Materiales, Departamento de Física, Universidad Nacional de Colombia, A.A. 5997, Bogotá D.C. (Colombia); Roa-Rojas, J., E-mail: jroar@unal.edu.co [Grupo de Física de Nuevos Materiales, Departamento de Física, Universidad Nacional de Colombia, A.A. 5997, Bogotá D.C. (Colombia)

2013-05-15

Sr{sub 2}HrRuO{sub 6} (Hr = Ho, Dy, Gd, Eu) complex perovskites were synthesized through the high-temperature solid-state reaction method, and their crystal structures were analyzed in detail as a function of the Hr-cation ionic radius. Results of powder XRD pattern measurement and Rietveld analysis of the experimental profiles show that the Sr{sub 2}HrRuO{sub 6} compounds crystallize in a monoclinic distorted perovskite-like structure, P2{sub 1}/n (#14) space group, where the unit cell parameters are related to the primitive unit cell a{sub p} by a≈√(2)a{sub p}, b≈√(2)a{sub p} and c ≈ 2a{sub p}. The structures show an alternate distribution of the Ru{sup 5+} (2d: 0.5, 0, 0) and Hr{sup 3+} (2c: 0, 0.5, 0) making up RuO{sub 6} and HrO{sub 6} octahedra alternatively arranged in two interleaving fcc sublattices, where the O(1), O(2), and O(3) ions are localized at the corner of the octahedral, while the Sr{sup 2+} is located at the A-site, occupying the cavities built by the corner-sharing octahedra with Wyckoff position 4e. Due to the existence of mismatched ionic sizes between the ionic radii of the Sr{sub 2}HrRuO{sub 6} compounds, the HrO{sub 6} and RuO{sub 6} octahedra are constrained to tilting around the [111]{sub c}, [001]{sub c}, and [110]{sub c} cubic directions so as to optimize the Sr–O inter-atomic bond lengths, tending to rotate the structure in order to fix the Ru{sup 5+} and Hr{sup 3+} ions on the M′ and M″ sites of the complex perovskites. The cell parameters a, b, and c, the inter-atomic bond angles, the inter-atomic bond lengths, and the tilting angles increase as the Hr-cation ionic radius increases. The mismatch that exists in the Sr{sub 2}HrRuO{sub 6} ionic radius produces a large distortion from the ideal cubic symmetry. The pure perovskite-like phase of Sr{sub 2}HrRuO{sub 6} is thermodynamically and kinetically stable at high temperatures above 1420 K, where it is entirely governed by the average size of the Hr{sup 3+} and Ru

Dynamic shock compaction of a ZrO2-RuO2 electronic nanocomposite: toward functionally graded materials

NARCIS (Netherlands)

van Zyl, W.E.; Carton, Erik P.; Raming, T.P.; ten Elshof, Johan E.; Verweij, H.

2005-01-01

An electronic ZrO2-RuO2 nanocomposite was fabricated by dynamic compaction (DC) at 1.5 GPa resulting in a maximum relative density of 88% in the material. The DC process formed pristine elongated conical-shaped compacts 3 cm in length. The compacts retained their original nanometer-sized grains (~20

Pt-Ru/CeO2/carbon nanotube nanocomposites: an efficient electrocatalyst for direct methanol fuel cells.

Science.gov (United States)

Sun, Zhenyu; Wang, Xiang; Liu, Zhimin; Zhang, Hongye; Yu, Ping; Mao, Lanqun

2010-07-20

Pt-Ru/CeO(2)/multiwalled carbon nanotube (MWNT) electrocatalysts were prepared using a rapid sonication-facilitated deposition method and were characterized by X-ray diffraction (XRD), X-ray photoemission spectroscopy (XPS), transmission electron microscopy (TEM), energy-dispersive spectroscopy (EDS), and voltammetry. Morphological characterization by TEM revealed that CeO(2) nanoparticles (NPs) were in intimate contact with Pt-Ru NPs, and both were highly dispersed on the exteriors of nanotubes with a small size and a very narrow size distribution. Compared with the Pt-Ru/MWNT and Pt/MWNT electrocatalysts, the as-prepared Pt-Ru/CeO(2)/MWNT exhibited a significantly improved electrochemically active surface area (ECSA) and a remarkably enhanced activity toward methanol oxidation. The effects of the Pt-Ru loading and the Pt-to-Ru molar ratio on the electrocatalytic activity of Pt-Ru/CeO(2)/MWNT for methanol oxidation were investigated. We found that a maximum activity toward methanol oxidation reached at the 10 wt % of Pt-Ru loading and 1:1 of Pt-to-Ru ratio. Moreover, the role of CeO(2) in the catalysts for the enhancement of methanol oxidation was discussed in terms of both bifunctional mechanism and electronic effects.

Nonacarbonyl-1κ3C,2κ3C,3κ3C-μ-bis(diphenylarsinomethane-1:2κ2As:As'-[tris(2-chloroethyl phosphite-3κP]-triangulo-triruthenium(0

Directory of Open Access Journals (Sweden)

Omar bin Shawkataly

2010-08-01

Full Text Available In the title triangulo-triruthenium(0 compound, [Ru3(C25H22As2(C6H12Cl3O3P(CO9], the bis(diphenylarsinomethane ligand bridges an Ru—Ru bond and the monodentate phosphine ligand bonds to the third Ru atom. Both the arsine and phosphine ligands are equatorial with respect to the Ru3 triangle. In addition, each Ru atom carries one equatorial and two axial terminal carbonyl ligands. In the crystal packing, the molecules are linked by intermolecular C—H...O hydrogen bonds into a three-dimensional framework. Weak intermolecular C—H...π interactions further stabilize the crystal structure.

5-Imino-3,4-diphenyl-1H-pyrrol-2-one

Science.gov (United States)

Bulatov, Evgeny; Chulkova, Tatiana; Haukka, Matti

2014-01-01

The title compound, C16H12N2O, exists in the crystalline state as the 5-imino-3,4-di­phenyl­-1H-pyrrol-2-one tautomer. The dihedral angles between the pyrrole and phenyl rings are 35.3 (2) and 55.3 (2)°. In the crystal, inversion dimers linked by pairs of N—H⋯N hydrogen bonds generate a graph-set motif of R 2 2(8) via N—H⋯N hydrogen bonds. PMID:24764881

New Ru(II) Complexes for Dual Photoreactivity: Ligand Exchange and 1O2 Generation

OpenAIRE

Knoll, Jessica D.; Albani, Bryan A.; Turro, Claudia

2015-01-01

Uncovering the factors that govern the electronic structure of Ru(II)–polypyridyl complexes is critical in designing new compounds for desired photochemical reactions, and strategies to tune excited states for ligand dissociation and 1O2 production are discussed herein. The generally accepted mechanism for photoinduced ligand dissociation proposes that population of the dissociative triplet ligand field (3LF) state proceeds through thermal population from the vibrationally cooled triplet meta...

Coordination polymers of scandium sulfate. Crystal structures of (H2Bipy)[Sc(H2O)(SO4)2]2·2H2O and (H2Bipy)[HSO4]2

International Nuclear Information System (INIS)

Petrosyants, S.P.; Ilyukhin, A.B.

2005-01-01

Compounds with general formula Cat x [Sc(H 2 O) z (SO 4 ) y ]·nH 2 O (Cat=NH 4 , H 2 Bipy (Bipy - 4,4'-bipyridine), HEdp (Edp - ethylene dipyridine)) identified on element analysis data and IR spectra are synthesized. X-ray diffraction analysis of (H 2 Bipy)[Sc(H 2 O)(SO 4 ) 2 ] 2 ·2H 2 O shows that in structure of the compound chains of ScO 6 octahedron and SO 4 tetrahedrons are joined in bands by tridentate coordination of sulfate ions. Bands form skeleton in endless emptiness of which there are H 2 Bipy 2+ cations [ru

MnO2/CNT supported Pt and PtRu nanocatalysts for direct methanol fuel cells.

Science.gov (United States)

Zhou, Chunmei; Wang, Hongjuan; Peng, Feng; Liang, Jiahua; Yu, Hao; Yang, Jian

2009-07-07

Pt/MnO2/carbon nanotube (CNT) and PtRu/MnO2/CNT nanocomposites were synthesized by successively loading hydrous MnO2 and Pt (or PtRu alloy) nanoparticles on CNTs and were used as anodic catalysts for direct methanol fuel cells (DMFCs). The existence of MnO2 on the surface of CNTs effectively increases the proton conductivity of the catalyst, which then could remarkably improve the performance of the catalyst in methanol electro-oxidation. As a result, Pt/MnO2/CNTs show higher electrochemical active surface area and better methanol electro-oxidation activity, compared with Pt/CNTs. As PtRu alloy nanoparticles were deposited on the surface of MnO2/CNTs instead of Pt, the PtRu/MnO2/CNT catalyst shows not only excellent electro-oxidation activity to methanol with forward anodic peak current density of 901 A/gPt but also good CO oxidation ability with lower preadsorbed CO oxidation onset potential (0.33 V vs Ag/AgCl) and peak potential (0.49 V vs Ag/AgCl) at room temperature.

Atomic-Scale View on the H₂O Formation Reaction from H₂ on O-Rich RuO₂(110)

DEFF Research Database (Denmark)

Wei, Yinying; Martinez, Umberto; Lammich, Lutz

2014-01-01

The H2O formation reaction from H-2 on O-rich RuO2(110) was studied by temperature-programmed desorption and reaction (TPD/TPR) and scanning tunneling microscopy (STM) measurements and density functional theory (DFT) calculations. On the one hand, following H-2 adsorption at 270 K, our TPD/TPR me...

Surface modification of RuO2 electrodes by laser irradiation and ion ...

Indian Academy of Sciences (India)

RuO2 thin layers were deposited on Ti supports by thermal decomposition of RuCl3 at 400°C. Some of the samples were subjected to laser irradiation between 0.5 and 1.5 J cm-2. Some others to Kr bombardment with doses between 1015 and 1016 cm-2. Modifications introduced by the surface treatments were monitored ...

Correlation effects and spin-orbit interaction in Sr{sub 3}Ru{sub 2}O{sub 7}: LDA+DMFT study

Energy Technology Data Exchange (ETDEWEB)

Gorelov, Evgeny; Zhang, Guoren; Pavarini, Eva [IAS-3, Forschungszentrum Juelich, 52425 Juelich (Germany)

2013-07-01

The layered ruthenates of the Ruddlesden-Popper family Sr{sub n+1}Ru{sub n}O{sub 3n+1} are interesting examples of strongly correlated transition metal compounds. Due to competing kinetic and Coulomb energies, that are of the same order for Ru 4d electrons, these compounds have very rich phase diagram, including Mott-insulator, ferro- and meta-magnetic phases. Among layered ruthenates the bilayered compound Sr{sub 3}Ru{sub 2}O{sub 7} is particularly interesting. It is known to be a paramagnetic metal close to ferro-magnetism and exhibits a metamagnetic behavior in external magnetic field. By using the LDA+DMFT (local-density approximation + dynamical mean-field theory) approach, we study magnetic properties and electron mass renormalization due to correlation effects. In our LDA+DMFT scheme we use maximally-localized Wannier orbitals obtained from Linearized Augmented Plane Wave (LAPW) calculations to build a low-energy Hubbard model for the Ru d bands; we use the weak-coupling CT-quantum Monte Carlo method to solve the quantum impurity problem. We take into account the full rotationally-invariant Coulomb interaction, as well as full on-site self-energy matrix in orbital space with spin-orbit coupling.

Chlorine Evolution Reaction on RuO2(110): Ab initio Atomistic Thermodynamics Study - Pourbaix Diagrams

International Nuclear Information System (INIS)

Exner, Kai S.; Anton, Josef; Jacob, Timo; Over, Herbert

2014-01-01

Graphical abstract: - Highlights: • Using the method Pourbaix diagram we identified the oxygen covered RuO 2 (110) surface as the catalytically active phase under chlorine evolution reaction (CER) conditions. This active phase is compared with the active phase in the Deacon process, the heterogeneous gas phase counterpart of the CER. - Abstract: Constrained ab initio thermodynamics in the form of a Pourbaix diagram can greatly assist kinetic modeling of a particular electrochemical reaction such as the chlorine evolution reaction (CER) over RuO 2 (110). Pourbaix diagrams reveal stable surface structures, as a function of pH and the potential. The present DFT study indicates that the Pourbaix diagram in the CER potential region above 1.36 V and pH values around zero is dominated by a stable surface structure in which all coordinatively undercoordinated Ru sites (Ru cus ) are capped by on-top oxygen (O ot ). This oxygen saturated RuO 2 (110) surface is considered to serve as the catalytically active phase in the CER, quite in contrast to the heterogeneously catalyzed HCl oxidation (Deacon process), for which the active RuO 2 (110) surface is mainly covered by on-top chlorine. The active sites in the CER are suggested to be Ru cus O ot surface complexes, while in the Deacon process both undercoordinated surface Ru and oxygen sites must be available for the activation of HCl molecules

Anodic composite deposition of RuO_2/reduced graphene oxide/carbon nanotube for advanced supercapacitors

International Nuclear Information System (INIS)

Hu, Chi-Chang; Wang, Chia-Wei; Chang, Kuo-Hsin; Chen, Ming-Guan

2015-01-01

Anodic composite deposition is demonstrated to be a unique method for fabricating a ternary ruthenium dioxide/reduced graphene oxide/carbon nanotube (RuO_2 · xH_2O/rGO/CNT, denoted as RGC) nanocomposite onto Ti as an advanced electrode material for supercapacitors. The rGO/CNT composite in RGCs acts as a conductive backbone to facilitate the electron transport between current collector and RuO_2 · xH_2O nanoparticles (NPs), revealed by the high total specific capacitance (C_S_,_T = 808 F g"−"1) of RGC without annealing. The contact resistance among RuO_2 · xH_2O NPs is improved by low-temperature annealing at 150 °C (RGC-150), which renders slight sintering and enhances the specific capacitance of RuO_2 · xH_2O to achieve 1200 F g"−"1. The desirable nanocomposite microstructure of RGC-150 builds up the smooth pathways of both protons and electrons to access the active oxy-ruthenium species. This nanocomposite exhibits an extremely high C_S_,_T of 973 F g"−"1 at 25 mV s"−"1 (much higher than 435 F g"−"1 of an annealed RuO_2 · xH_2O deposit) and good capacitance retention (60.5% with scan rate varying from 5 to 500 mV s"−"1), revealing an advanced electrode material for high-performance supercapacitors. (paper)

Orientation-Dependent Oxygen Evolution on RuO₂ without Lattice Exchange

DEFF Research Database (Denmark)

Stoerzinger, Kelsey A.; Diaz-Morales, Oscar; Kolb, Manuel

2017-01-01

the potential involvement of lattice oxygen in the OER mechanism with online electrochemical mass spectrometry, which showed no evidence of oxygen exchange on these oriented facets in acidic or basic electrolytes. Similar results were obtained for polyoriented RuO2 films and particles, in contrast to previous...... work, suggesting lattice oxygen is not exchanged in catalyzing OER on crystalline RuO2 surfaces. This hypothesis is supported by the correlation of activity with the number of active Ru-sites calculated by density functional theory, where more active facets bind oxygen more weakly. This new...

Ir-Ru/Al2O3 catalysts used in satellite propulsion

Directory of Open Access Journals (Sweden)

T.G. Soares Neto

2003-09-01

Full Text Available Ir/Al2O3, Ir-Ru/Al2O3 and Ru/Al2O3, catalysts with total metal contents of 30% were prepared using the methods of incipient wetness and incipient coimpregnation wetness and were tested in a 2N microthruster. Their performances were then compared with that of the Shell 405 commercial catalyst (30% Ir/Al2O3. Tests were performed in continuous and pulsed regimes, where there are steep temperature and pressure gradients, from ambient values up to 650 ºC and 14 bar. Performance stability, thrust produced, temperature and stagnation pressure in the chamber and losses of mass were analyzed and compared to the corresponding parameters in Shell 405 tests. It was observed that the performance of all the above-mentioned catalysts was comparable to that of the commercial one, except for in loss of mass, where the values was higher, which was attributed to the lower mechanical resistance of the support.

Redox and catalytic properties of new polypyrrole modified electrodes functionalized by [Ru(bpea)(bpy)H{sub 2}O]{sup 2+} complexes; bpea=N,N'-bis(2-pyridylmethyl)ethylamine, bpy=2,2'-bipyridine

Energy Technology Data Exchange (ETDEWEB)

Rodriguez, Montserrat; Romero, Isabel; Sens, Cristina; Llobet, Antoni; Deronzier, Alain

2003-04-05

New ruthenium(II) complexes containing one or two pyrrole-functionalized polypyridylic ligands have been prepared in order to study their electrochemical behaviour in heterogeneous phase, after anodic polymerization from CH{sub 2}Cl{sub 2} solution on an electrode surface. Complexes containing one pyrrole unit have general formula [Ru(bpea-pyr)(bpy)(L)]{sup 2+} (bpea-pyr=N-[3-bis(2-pyridylmethyl)aminopropyl]pyrrole, bpy=2,2'-bipyridine, L=Cl, complex 3, or L=H{sub 2}O, complex 1), whereas compounds having two pyrrole units correspond to [Ru(bpea-pyr)(bpy-pyr)(L)]{sup 2+} (bpy-pyr=4-methyl-4'-pyrrolylbutyl-2,2'-bipyridine, L=Cl, complex 4, or L=H{sub 2}O, complex 2). Upon oxidative polymerization, all complexes form highly stable polypyrrolic films on a graphite disk electrode surface. An electrode modified with complex 2 polypyrrole coating film, C/poly-2, has been tested as heterogeneous catalyst for the oxidation of benzyl alcohol, showing a remarkably high efficiency and notably improving the results obtained with analogous complexes in homogeneous phase.

Mixed valent perovskites Ba/sub 3/B/sup 3 +/Ru/sub 2/sup(4. 5+)O/sub 9/. Catalytic activity of perovskite oxides with noble metals

Energy Technology Data Exchange (ETDEWEB)

Treiber, U; Kemmler-Sack, S; Ehmann, A; Schaller, H U; Duerrschmidt, E; Thumm, I; Bader, H [Tuebingen Univ. (Germany, F.R.). Lehrstuhl fuer Anorganische Chemie 2

1981-10-01

The black compounds Ba/sub 3/B/sup 3 +/Ru/sub 2/O/sub 9/ crystallize with B/sup 3 +/ = La, Nd, Sm, Eu, Gd, Dy, Ho, Er, Tm, Yb, and Y in a hexagonal BaTiO/sub 3/ structure (6L, sequence (hcc)/sub 2/) with an ordered distribution (1:2 order) of B/sup 3 +/ and ruthenium (BO/sub 6/ single octahedra; Ru/sub 2/O/sub 9/ double groups). The mean oxidation state of ruthenium is about +4.5. The properties are compared with those of other isotypic stacking polytypes Ba/sub 3/B/sup 3 +/M/sub 2/sup(4.5)O/sub 9/ (M/sub 2/ = IrRu, Ir/sub 2/, PtRu) and Ba/sub 3/B/sup 2 +/M/sub 2//sup 5 +/O/sub 9/ (M = Ru, Ir). The results of activity tests concerning the efficiency of perovskite oxides with noble metals in respect of the oxidation of CO or CHsub(x) and the reduction of NOsub(x) are reported.

Hydrothermal synthesis, structures and optical properties of A2Zn3(SeO3)4·XH2O (A=Li, Na, K; X=2 or 0)

Science.gov (United States)

Liu, Yunsheng; Mei, Dajiang; Xu, Jingli; Wu, Yuandong

2015-12-01

New alkali metal zinc selenites, A2Zn3(SeO3)4·XH2O (A=Li, Na, K; X=2 or 0) were prepared through hydrothermal reactions. Li2Zn3(SeO3)4·2H2O (1) crystallizes in the monoclinic space group P21/c with lattice parameters a=8.123(4), b=9.139(4), c=7.938(3) Å, β=112.838(9)°. Na2Zn3(SeO3)4·2H2O (2) crystallizes in the monoclinic space group C2/c with lattice parameters a=15.7940(18), b=6.5744(8), c=14.6787(17) Å, β=107.396(3)°. K2Zn3(SeO3)4 (3) crystallizes in the monoclinic space group C2/c with lattice parameters a=11.3584(12), b=8.6091(9), c=13.6816(14) Å, β=93.456(2)°. The anionic structures are composed of [Zn3O12]18- sheets, chains, and "isolated" units in compound 1, 2, 3, respectively, and trigonal pyramids SeO32-. The compounds were characterized by the solid state UV-vis-NIR diffuse reflectance spectroscopy, infrared spectra and thermogravimetric analysis.

Annealing-temperature-dependent voltage-sign reversal in all-oxide spin Seebeck devices using RuO2

Science.gov (United States)

Kirihara, Akihiro; Ishida, Masahiko; Yuge, Ryota; Ihara, Kazuki; Iwasaki, Yuma; Sawada, Ryohto; Someya, Hiroko; Iguchi, Ryo; Uchida, Ken-ichi; Saitoh, Eiji; Yorozu, Shinichi

2018-04-01

Thermoelectric converters based on the spin Seebeck effect (SSE) have attracted great attention due to their potential to offer novel applications such as energy harvesting and heat-flow sensing. For converting a SSE-induced spin current into an electric current, a transition metal film such as Pt, which exhibits large inverse spin-Hall effect (ISHE), has been typically used. In this work, we show an all-oxide SSE device using ruthenium oxide (RuO2) as a conductive film. We found that both the sign and magnitude of the SSE-induced ISHE voltage V appearing in the RuO2 film changes depending on the post annealing temperature, and that the magnitude can become larger than that of a standard SSE device using Pt. The similar sign change was also observed in Hall-resistance measurements of the RuO2 films. X-ray absorption fine structure (XAFS) spectra of as-deposited and annealed RuO2 revealed that the annealing process substantially improved the long-range crystalline order in RuO2. This suggests that change in the crystalline order may modify the dominant ISHE mechanism or electronic states in RuO2, leading to the sign reversal of V as well as the Hall coefficient. Our result demonstrates that RuO2 is an interesting material not only as a practical ISHE film but also as a testbed to study physics of spin-to-charge converters that depend on their crystalline order.

5-Imino-3,4-diphenyl-1H-pyrrol-2-one

Directory of Open Access Journals (Sweden)

Evgeny Bulatov

2014-02-01

Full Text Available The title compound, C16H12N2O, exists in the crystalline state as the 5-imino-3,4-diphenyl-1H-pyrrol-2-one tautomer. The dihedral angles between the pyrrole and phenyl rings are 35.3 (2 and 55.3 (2°. In the crystal, inversion dimers linked by pairs of N—H...N hydrogen bonds generate a graph-set motif of R22(8 via N—H...N hydrogen bonds.

RuO2/MnO2 composite materials for high-performance supercapacitor electrodes

Science.gov (United States)

Jianming, Lei; Xiaomei, Chen

2015-08-01

Ruthenium oxide and manganese oxide nanomaterials were respectively prepared by a sol-gel process and hydrothermal synthesis method. The morphologies and microstructures of the composite nanomaterials were characterized by SEM and XRD. Based on the cyclic voltammetry, electrochemical impedance spectroscopy and constant current charge-discharge techniques, the performances of the electrodes were investigated. The results show that the composite of manganese oxide and ruthenium oxide is beneficial to improve the impedance characteristic. The electrode with 60% (mass ratio) manganese oxide has a high specific capacitance of 438 F/g and a lower inner resistance of 0.304 Ω using 38% (mass ratio) H2SO4 solution. The capacitance retention of RuO2/MnO2 composite electrode was 92.5% after 300 cycles.

RuO2/MnO2 composite materials for high-performance supercapacitor electrodes

International Nuclear Information System (INIS)

Lei Jianming; Chen Xiaomei

2015-01-01

Ruthenium oxide and manganese oxide nanomaterials were respectively prepared by a sol–gel process and hydrothermal synthesis method. The morphologies and microstructures of the composite nanomaterials were characterized by SEM and XRD. Based on the cyclic voltammetry, electrochemical impedance spectroscopy and constant current charge–discharge techniques, the performances of the electrodes were investigated. The results show that the composite of manganese oxide and ruthenium oxide is beneficial to improve the impedance characteristic. The electrode with 60% (mass ratio) manganese oxide has a high specific capacitance of 438 F/g and a lower inner resistance of 0.304 Ω using 38% (mass ratio) H 2 SO 4 solution. The capacitance retention of RuO 2 /MnO 2 composite electrode was 92.5% after 300 cycles. (paper)

Selective CO Methanation on Ru/TiO2 Catalysts: Role and Influence of Metal-Support Interactions

DEFF Research Database (Denmark)

Abdel-Mageed, Ali M.; Widmann, D.; Olesen, Sine Ellemann

2015-01-01

Aiming at a detailed understanding of the role of metal-support interactions in the selective methanation of CO in CO2-rich reformate gases, we have investigated the catalytic performance of a set of Ru/TiO2 catalysts with comparable Ru loading, Ru particle size, and TiO2 phase composition but very...... different surface areas (ranging from 20 to 235 m2 g-1) in this reaction. The activity for CO methanation, under steady-state conditions, was found to strongly depend on the TiO2 support surface area, increasing first with increasing surface area up to a maximum activity for the Ru/TiO2 catalyst...... with a surface area of 121 m2 g-1 and then decreasing for an even higher surface area; however, the selectivity is mainly determined by the Ru particle size, which slightly decreases with increasing support surface area. This goes along with an increase in selectivity for CO methanation, in agreement...

X-ray photoelectron spectroscopic and electrochemical impedance spectroscopic analysis of RuO_2-Ta_2O_5 thick film pH sensors

International Nuclear Information System (INIS)

Manjakkal, Libu; Cvejin, Katarina; Kulawik, Jan; Zaraska, Krzysztof; Socha, Robert P.; Szwagierczak, Dorota

2016-01-01

The paper reports on investigation of the pH sensing mechanism of thick film RuO_2-Ta_2O_5 sensors by using X-ray photoelectron spectroscopy (XPS) and electrochemical impedance spectroscopy (EIS). Interdigitated conductimetric pH sensors were screen printed on alumina substrates. The microstructure and elemental composition of the films were examined by scanning electron microscopy and energy dispersive spectroscopy. The XPS studies revealed the presence of Ru ions at different oxidation states and the surface hydroxylation of the sensing layer increasing with increasing pH. The EIS analysis carried out in the frequency range 10 Hz–2 MHz showed that the electrical parameters of the sensitive electrodes in the low frequency range were distinctly dependent on pH. The charge transfer and ionic exchange occurring at metal oxide-solution interface were indicated as processes responsible for the sensing mechanism of thick film RuO_2-Ta_2O_5 pH sensors. - Highlights: • Conductimetric pH sensors with RuO_2-Ta_2O_5 thick film electrodes were developed. • Microstructure and elemental composition of the films were examined by SEM and EDX. • Sensing film composition and hydroxylation were studied by XPS as a function of pH. • Electrochemical reactions at oxide-solution interface were analyzed by EIS method. • Impact of solution pH, electrode composition and sintering temperature was studied.

Photoelectrochemical water splitting for hydrogen production using combination of CIGS2 solar cell and RuO2 photocatalyst

International Nuclear Information System (INIS)

Dhere, Neelkanth G.; Jahagirdar, Anant H.

2005-01-01

This paper presents the development of photoelectrochemical (PEC) cell for water splitting setup using multiple band gap combination of CuIn 1-x Ga x S 2 (CIGS2) thin-film photovoltaic (PV) cell and ruthenium oxide (RuO 2 ) photocatalyst. FSEC PV Materials Lab has developed a PEC setup consisting of two illuminated CIGS2 cells, a ruthenium oxide (RuO 2 ) anode deposited on titanium sheet for oxygen evolution and a platinum foil cathode for hydrogen evolution. With this combination, a PEC efficiency of 4.29% has been achieved. This paper also presents the research aimed at further improvements in the PEC efficiency by employing highly efficient photoanode that can be illuminated by photons not absorbed at the PV cell and by increasing the concentration of electrolyte solution (pH 10). The former will be achieved by employing a p-type transparent and conducting layer at the back of PV cell to transmit the unabsorbed photons, and the latter will reduce the resistance offered by the electrolyte. Concentration of the electrolyte was increased by five times, and the I-V characteristics of both RuO 2 and RuS 2 were measured with and without illumination. The results indicate that PEC efficiencies of over 9% can be achieved using RuS 2 with illumination and five times concentrated pH 10 solution instead of pH 10 with normal concentration

1-(4a,8-Dimethyl-1,2,3,4,4a,5,6,8a-octahydronaphthalen-2-yl-3-(4-methylphenylprop-2-en-1-one

Directory of Open Access Journals (Sweden)

Mohamed Tebbaa

2011-06-01

Full Text Available The title compound, C22H28O, was isolated from the aerial part of Inula viscosa (L Aiton [or Dittrichia viscosa (L Greuter]. The cyclohexene ring has a half-chair conformation, whereas the cyclohexane ring displays a chair conformation being substituted at position 2 by a 3-(4-methylphenylprop-2-enoyl group. In the crystal, weak intermolecular C—H...O hydrogen bonds link molecules into chains in the [010] direction.

Hydrogenation of naphthalene on NiMo- Ni- and Ru/Al{sub 2}O{sub 3} catalysts. Langmuir-Hinshelwood kinetic modelling

Energy Technology Data Exchange (ETDEWEB)

Monteiro-Gezork, Ana Cristina Alves; Winterbottom, John Mike [Department of Chemical Engineering, School of Engineering, The University of Birmingham, Birmingham B15 2TT (United Kingdom); Natividad, Reyna [Department of Chemical Engineering, Faculty of Chemistry, Universidad Autonoma del Estado de Mexico, Paseo Colon Esq. Tollocan, Toluca, Edo. de Mexico, Mexico CP 50120 (Mexico)

2008-01-30

The importance of the hydrodearomatisation (HDA) is increasing together with tightening legislation of fuel quality and exhaust emissions. The present study focuses on hydrogenation (HYD) kinetics of the model aromatic compound naphthalene, found in typical diesel fraction, in n-hexadecane over a NiMo (nickel molybdenum), Ni (nickel) and Ru (ruthenium) supported on trilobe alumina (Al{sub 2}O{sub 3}) catalysts. Kinetic reaction expressions based on the mechanistic Langmuir-Hinshelwood (L-H) model were derived and tested by regressing the experimental data that translated the effect of both naphthalene and hydrogen concentration at a constant temperature (523.15 and 573.15 K over the NiMo catalyst and at 373.15 K over the Ni and Ru/Al{sub 2}O{sub 3} catalysts) on the initial reaction rate. The L-H equation, giving an adequate fit to the experimental data with physically meaningful parameters, suggested a competitive adsorption between hydrogen and naphthalene over the presulphided NiMo catalyst and a non-competitive adsorption between these two reactants over the prereduced Ni and Ru/Al{sub 2}O{sub 3} catalysts. In addition, the adsorption constant values indicated that the prereduced Ru catalyst was a much more active catalyst towards naphthalene HYD than the prereduced Ni/Al{sub 2}O{sub 3} or the presulphided NiMo/Al{sub 2}O{sub 3} catalyst. (author)

Synthesis, characterization of a new photosensitive compound [Ru(bpy)2 (TPAD)](PF6)2 and its application for photocatalytic hydrogen production

Science.gov (United States)

Zheng, Hui-Qin; Guo, Yi-Ping; Yin, Ming-Cai; Fan, Yao-Ting

2016-06-01

A new photosensitive compound based on triphenylamine donor and ruthenium(II), namely [Ru(bpy)2(TPAD)](PF6)2 (PS1, bpy = 2,2‧-bipyridine, TPAD = N-(4-(1H-imidazo[4,5-f][1,10] phenanthroline-2-yl)phenyl)-N-phenylbenzenamine), had been synthesized and characterized by elemental analysis, 1H NMR, MS spectra, UV, PL and CV measurements. The target photocatalyst, PS1/0.5 wt% Pt/TiO2, was prepared by sensitizing PS1 to 0.5 wt% Pt/TiO2 and characterized by SEM and XRD. The highest hydrogen evolution reached to 9500 μmol·(g·catalyst)-1 (475 μmol, 31.7 TON and TOF 5.8 vs. PS1) under the optimal conditions with 0.05 g·L-1 of PS1, and 5% of TEOA at pH 11 with the irradiation of 5.5 h. The mechanism of hydrogen evolution was also briefly discussed in the present work.

[μ2-Bis(diphenylphosphanylhexane]bis[undecacarbonyl-triangulo-triruthenium(3 Ru—Ru] hexane monosolvate: crystal structure and Hirshfeld surface analysis

Directory of Open Access Journals (Sweden)

Omar bin Shawkataly

2017-11-01

Full Text Available In the title cluster complex hexane solvate, [Ru6(C30H32P2(CO22]·C6H14, two Ru3(CO11 fragments are linked by a Ph2P(CH26PPh2 bridge with the P atoms equatorially disposed with respect to the Ru3 triangle in each case; the hexane solvent molecule is statistically disordered. The Ru...Ru distances span a relatively narrow range, i.e. 2.8378 (4 to 2.8644 (4 Å. The hexyl chain within the bridge has an all-trans conformation. In the molecular packing, C—H...O interactions between cluster molecules, and between cluster and hexane solvent molecules lead to a three-dimensional architecture. In addition, there are a large number of C[triple-bond]O...π(arene interactions in the crystal. The importance of the carbonyl groups in establishing the packing is emphasized by the contribution of 53.4% to the Hirshfeld surface by O...H/H...O contacts.

Partitioning of rhodium and ruthenium between Pd–Rh–Ru and (Ru,Rh)O{sub 2} solid solutions in high-level radioactive waste glass

Energy Technology Data Exchange (ETDEWEB)

Sugawara, Toru, E-mail: toru@gipc.akita-u.ac.jp [Center for Engineering Science, Akita University, 1-1, Tegatagakuenmachi, Akita City, Akita 010-8502 (Japan); Ohira, Toshiaki [Center for Engineering Science, Akita University, 1-1, Tegatagakuenmachi, Akita City, Akita 010-8502 (Japan); Komamine, Satoshi; Ochi, Eiji [Research and Development Department, Reprocessing Business Division, Japan Nuclear Fuel Limited, 4-108, Okitsuke, Obuchi, Rokkasho-mura, Aomori 039-3212 (Japan)

2015-10-15

The partitioning of rhodium and ruthenium between Pd–Rh–Ru alloy with a face-centered cubic (FCC) structure and (Ru,Rh)O{sub 2} solid solution has been investigated between 1273 and 1573 K at atmospheric oxygen fugacity. The rhodium and ruthenium contents in FCC increase, while the RhO{sub 2} content in (Ru,Rh)O{sub 2} decreases with increasing temperature due to progressive reduction of the system. Based on the experimental results and previously reported thermodynamic data, the thermodynamic mixing properties of FCC phase and (Ru,Rh)O{sub 2} have been calibrated in an internally consistent manner. Phase equilibrium of platinum grope metals in an HLW glass was calculated by using the obtained thermodynamic parameters.

Structural and electronic behavior of Sr2GdRuO6 complex perovskite

International Nuclear Information System (INIS)

Corredor, L.T.; Velasco Zarate, J.; Landinez Tellez, D.A.; Fajardo, F.; Arbey Rodriguez M, J.; Roa-Rojas, J.

2009-01-01

We report experimental and theoretical study of crystallographic lattice and electronic structure of Sr 2 GdRuO 6 complex perovskite, which is used as precursor in the fabrication process of superconducting ruthenocuprate RuSr 2 GdCu 2 O 8 . Samples were produced by the standard solid state reaction. Rietveld refinement of experimental X-ray diffraction patterns shows that material crystallizes in a monoclinic structure, which belongs to the P2 1 /n (no.14) space group, with lattice parameters a=5.8019(6)A, b=5.8296(5)A, c=8.2223(7)A, and tilt angle β=90.258 deg. Calculations of electronic structure were performed by the density functional theory. The exchange and correlation potentials were included through the LDA+U approximation. Density of states (DOS) study was carried out considering the two spin polarizations. Results show Gd are majority responsible for the magnetic character in this material, but Ru contribution is also relevant because d-orbital is closer to Fermi level. Theoretical results evidence that Sr 2 GdRuO 6 material behaves as a magnetic semiconductor, with 20μ B effective magnetic moment.

Photochemical Properties and Reactivity of a Ru Compound Containing an NAD/NADH-Functionalized 1,10-Phenanthroline Ligand.

Science.gov (United States)

Kobayashi, Katsuaki; Ohtsu, Hideki; Nozaki, Koichi; Kitagawa, Susumu; Tanaka, Koji

2016-03-07

An NAD/NADH-functionalized ligand, benzo[b]pyrido[3,2-f][1,7]-phenanthroline (bpp), was newly synthesized. A Ru compound containing the bpp ligand, [Ru(bpp)(bpy)2](2+), underwent 2e(-) and 2H(+) reduction, generating the NADH form of the compound, [Ru(bppHH)(bpy)2](2+), in response to visible light irradiation in CH3CN/TEA/H2O (8/1/1). The UV-vis and fluorescent spectra of both [Ru(bpp)(bpy)2](2+) and [Ru(bppHH)(bpy)2](2+) resembled the spectra of [Ru(bpy)3](2+). Both complexes exhibited strong emission, with quantum yields of 0.086 and 0.031, respectively; values that are much higher than those obtained from the NAD/NADH-functionalized complexes [Ru(pbn)(bpy)2](2+) and [Ru(pbnHH)(bpy)2](2+) (pbn = (2-(2-pyridyl)benzo[b]-1.5-naphthyridine, pbnHH = hydrogenated form of pbn). The reduction potential of the bpp ligand in [Ru(bpp)(bpy)2](2+) (-1.28 V vs SCE) is much more negative than that of the pbn ligand in [Ru(pbn)(bpy)2](2+) (-0.74 V), although the oxidation potentials of bppHH and pbnHH are essentially equal (0.95 V). These results indicate that the electrochemical oxidation of the dihydropyridine moiety in the NADH-type ligand was independent of the π system, including the Ru polypyridyl framework. [Ru(bppHH)(bpy)2](2+) allowed the photoreduction of oxygen, generating H2O2 in 92% yield based on [Ru(bppHH)(bpy)2](2+). H2O2 production took place via singlet oxygen generated by the energy transfer from excited [Ru(bppHH)(bpy)2](2+) to triplet oxygen.

Synthesis and characterisation of dual-phase Y-TZP and RuO2 nanopowders: dense electrode precursors.

NARCIS (Netherlands)

van Zyl, W.E.; Winnubst, Aloysius J.A.; Raming, T.P.; Schmuhl, R.; Verweij, H.

2002-01-01

The synthesis and characterisation of nanopowders in the dual-phase system tetragonal-Y2O3-doped ZrO2 (Y-TZP) and RuO2 are described. Five powders were prepared from a co-precipitation (CP) method with stoichiometric variation in the RuO2 content (5–46 mol%) and two powders were prepared from

All Pseudocapacitive MXene-RuO2 Asymmetric Supercapacitors

KAUST Repository

Jiang, Qiu

2018-01-23

2D transition metal carbides and nitrides, known as MXenes, are an emerging class of 2D materials with a wide spectrum of potential applications, in particular in electrochemical energy storage. The hydrophilicity of MXenes combined with their metallic conductivity and surface redox reactions is the key for high-rate pseudocapacitive energy storage in MXene electrodes. However, symmetric MXene supercapacitors have a limited voltage window of around 0.6 V due to possible oxidation at high anodic potentials. In this study, the fact that titanium carbide MXene (Ti3C2Tx) can operate at negative potentials in acidic electrolyte is exploited, to design an all-pseudocapacitive asymmetric device by combining it with a ruthenium oxide (RuO2) positive electrode. This asymmetric device operates at a voltage window of 1.5 V, which is about two times wider than the operating voltage window of symmetric MXene supercapacitors, and is the widest voltage window reported to date for MXene-based supercapacitors. The complementary working potential windows of MXene and RuO2, along with proton-induced pseudocapacitance, significantly enhance the device performance. As a result, the asymmetric devices can deliver an energy density of 37 µW h cm−2 at a power density of 40 mW cm−2, with 86% capacitance retention after 20 000 charge–discharge cycles. These results show that pseudocapacitive negative MXene electrodes can potentially replace carbon-based materials in asymmetric electrochemical capacitors, leading to an increased energy density.

Functional properties of electrospun NiO/RuO{sub 2} composite carbon nanofibers

Energy Technology Data Exchange (ETDEWEB)

Wu Yongzhi [Healthcare and Energy Materials Laboratory, Nanoscience and Nanotechnology Initiative, National University of Singapore, Singapore 117576 (Singapore); Physics Department, National University of Singapore, Singapore 117542 (Singapore); NUS Graduate School for Integrated Science and Engineering, 10 Kent Ridge Crescent, National University of Singapore, Singapore 119260 (Singapore); Balakrishna, Rajiv [Healthcare and Energy Materials Laboratory, Nanoscience and Nanotechnology Initiative, National University of Singapore, Singapore 117576 (Singapore); Physics Department, National University of Singapore, Singapore 117542 (Singapore); Reddy, M.V., E-mail: phymvv@nus.edu.sg [Physics Department, National University of Singapore, Singapore 117542 (Singapore); Nair, A. Sreekumaran, E-mail: nniansn@nus.edu.sg [Healthcare and Energy Materials Laboratory, Nanoscience and Nanotechnology Initiative, National University of Singapore, Singapore 117576 (Singapore); Chowdari, B.V.R. [Physics Department, National University of Singapore, Singapore 117542 (Singapore); Ramakrishna, S. [Healthcare and Energy Materials Laboratory, Nanoscience and Nanotechnology Initiative, National University of Singapore, Singapore 117576 (Singapore); Kind Saud University, Riyadh 11451 (Saudi Arabia)

2012-03-15

Highlights: Black-Right-Pointing-Pointer Fabrication of carbon nanofibers with nickel-ruthenium composites by electrospinning. Black-Right-Pointing-Pointer An interesting observation of increase in capacitance with increase in the number of cycles for supercapacitor applications. Black-Right-Pointing-Pointer Li ion battery testing showed a stable capacity ranging from 350 mAh g{sup -1} to 400 mAh g{sup -1}. Black-Right-Pointing-Pointer Lower impedance with the incorporation of 15 wt% Ru precursor than those without Ru. - Abstract: One-dimensional (1D) nickel oxide/ruthenium oxide (NiO/RuO{sub 2})-carbon composite nanofibers (NiRu-C-NFs) were fabricated via electrospinning of a homogenous mixture of polyacrylonitrile (PAN) and Ni/Ru salt precursors at different ratios followed by heat treatments. The 1D nanostructures of the composite material were characterized by field-emission scanning electron microscopy (FE-SEM), powder X-ray diffraction (XRD), Rietveld refinement and Brunauer-Emmett-Teller (BET) surface area measurements. Li-cycling properties were evaluated using cyclic voltammetry and galvanostatic properties. The asymmetric hybrid supercapacitor studies were carried out with activated carbon as a cathode and NiRu-C-NFs composites as anodes in the cycling range, 0.005-3.0 V using 1 M LiPF{sub 6} (EC;DMC) electrolyte. NiRu-C-NFs fabricated from 5 wt% nickel (II) and 15 wt% ruthenium (III) precursors showed a capacitance up to {approx}60 F g{sup -1} after 30 cycles. Anodic Li-cycling studies of NiRu-C-NF-0 and NiRu-C-NF-2 composite samples showed a reversible capacity of 230 and 350 m Ahg{sup -1} at current rate of 72 mA g{sup -1} at the end of 40th cycle in the voltage range of 0.005-3.0 V. Electrochemical impedance studies (EIS) on NiRu-C-NFs showed lower impedance value for 15 wt% Ru than the bare sample.

2-(2-Pyridylpyridinium (2,2′-bipyridine-κ2N,N′tetrakis(nitrato-κ2O,O′bismuthate(III

Directory of Open Access Journals (Sweden)

Shu-Shen Zhang

2011-10-01

Full Text Available The structure of the title compound, (C10H9N2[Bi(NO34(C10H8N2], consists of 2-(2-pyridylpyridinium cations and anions [Bi(NO34(C10H8N2]−. The Bi3+ ion lies on the twofold axis. It is coordinated by two nitrogen atoms from one 2,2′-bipyridine ligand and eight oxygen atoms from four NO3− anions. The disordered cation is positioned at the inversion centre. The [Bi(NO34(C10H8N2]− anions and 2-(2-pyridylpyridinium cations are connected via N—H...O hydrogen bonds into chains. Moreover, these chains are further linked into a two-dimensional layered structure through π–π stacking interactions between bipyridine ligands along the c axis [centroid–centroid distance = 2.868 (4 Å].

[(2S-2-(3,5-Dichloro-2-oxidobenzylideneamino-3-(4-hydroxyphenylpropionato-κ3O,N,O′](dimethylformamide-κOcopper(II

Directory of Open Access Journals (Sweden)

Hong Liang

2008-04-01

Full Text Available In the title complex, [Cu(C16H11Cl2NO4(C3H7NO] , the CuII atom is coordinated by two O atoms and one N atom from the tridentate ligand L2− {LH2 = (2S-[2-(3,5-dichloro-2-hydroxybenzylideneimino]-3-(4-hydroxyphenylpropionic acid} and one O atom from a dimethylformamide molecule, resulting in a slightly distorted square-planar geometry. The structure forms a one-dimensional chain through weak coordination bonds [Cu...O 3.080 (1, Cu...Cl 3.269 (1 Å] and a three-dimensional network through O—H...O and C—H...O hydrogen bonds.

Atomic resolution observation of conversion-type anode RuO 2 during the first electrochemical lithiation

KAUST Repository

Mao, Minmin; Nie, Anmin; Liu, Jiabin; Wang, Hongtao; Mao, Scott X; Wang, Qingxiao; Li, Kun; Zhang, Xixiang

2015-01-01

. In situ transmission electron microscopy reveals a two-step process during the initial lithiation of the RuO2 nanowire anode at atomic resolution. The first step is characterized by the formation of the intermediate phase LixRuO2 due to the Li

Application of Ti/RuO{sub 2}-Ta{sub 2}O{sub 5} electrodes in the electrooxidation of ethanol and derivants: Reactivity versus electrocatalytic efficiency

Energy Technology Data Exchange (ETDEWEB)

Ribeiro, J.; De Andrade, A.R. [Departamento de Quimica, Faculdade de Filosofia Ciencias e Letras de Ribeirao Preto, Universidade de Sao Paulo, 14040-9010 Ribeirao Preto, SP (Brazil); Purgato, F.L.S. [Departamento de Quimica, Faculdade de Filosofia Ciencias e Letras de Ribeirao Preto, Universidade de Sao Paulo, 14040-9010 Ribeirao Preto, SP (Brazil); Equipe Electrocatalyse, UMR 6503 CNRS, Universite de Poitiers, 40 Avenue du Recteur Pineau 86022 Poitiers Cedex (France); Kokoh, K.B.; Leger, J.-M. [Equipe Electrocatalyse, UMR 6503 CNRS, Universite de Poitiers, 40 Avenue du Recteur Pineau 86022 Poitiers Cedex (France)

2008-11-15

The influence of the preparation method on the performance of RuO{sub 2}-Ta{sub 2}O{sub 5} electrodes was evaluated toward the ethanol oxidation reaction (EOR). Freshly prepared RuO{sub 2}-Ta{sub 2}O{sub 5} thin films containing between 30 and 80 at.% Ru were prepared by two different methods: the modified Pechini-Adams method (DPP) and standard thermal decomposition (STD). Electrochemical investigation of the electrode containing RuO{sub 2}-Ta{sub 2}O{sub 5} thin films was conducted as a function of electrode composition in a 0.5-mol dm{sup -3} H{sub 2}SO{sub 4} solution, in the presence and absence of ethanol and its derivants (acetaldehyde and acetic acid). At a low ethanol concentration (5 mmol dm{sup -3}), ethanol oxidation leads to high yields of acetic acid and CO{sub 2}. On the other hand, an increase in ethanol concentration (15-1000 mmol dm{sup -3}) favors acetaldehyde formation, so acetic acid and CO{sub 2} production is hindered, in this case. Electrodes prepared by DPP provide higher current efficiency than STD electrodes for all the investigated ethanol concentrations. This may be explained by the increase in electrode area obtained with the DPP preparation method compared with STD. (author)

cis-Bis(O-methyl­dithio­carbonato-κ2 S,S′)bis­(tri­phenyl­phosphane-κP)ruthenium(II)

Science.gov (United States)

Valerio-Cárdenas, Cintya; Hernández-Ortega, Simón; Reyes-Martínez, Reyna; Morales-Morales, David

2013-01-01

In the title compound, [Ru(CH3OCS2)2(C18H15P)2], the RuII atom is in a distorted octa­hedral coordination by two xanthate anions (CH3OCS2) and two tri­phenyl­phosphane (PPh3) ligands. Both bidentate xanthate ligands coordinate the RuII atom with two slightly different Ru—S bond lengths but with virtually equal bite angles [71.57 (4) and 71.58 (3)°]. The packing of the complexes is assured by C—H⋯O and C—H⋯π inter­actions. PMID:24046578

Vertical Line Nodes in the Superconducting Gap Structure of Sr_{2}RuO_{4}

Directory of Open Access Journals (Sweden)

E. Hassinger

2017-03-01

Full Text Available There is strong experimental evidence that the superconductor Sr_{2}RuO_{4} has a chiral p-wave order parameter. This symmetry does not require that the associated gap has nodes, yet specific heat, ultrasound, and thermal conductivity measurements indicate the presence of nodes in the superconducting gap structure of Sr_{2}RuO_{4}. Theoretical scenarios have been proposed to account for the existence of deep minima or accidental nodes (minima tuned to zero or below by material parameters within a p-wave state. Other scenarios propose chiral d-wave and f-wave states, with horizontal and vertical line nodes, respectively. To elucidate the nodal structure of the gap, it is essential to know whether the lines of nodes (or minima are vertical (parallel to the tetragonal c axis or horizontal (perpendicular to the c axis. Here, we report thermal conductivity measurements on single crystals of Sr_{2}RuO_{4} down to 50 mK for currents parallel and perpendicular to the c axis. We find that there is substantial quasiparticle transport in the T=0 limit for both current directions. A magnetic field H immediately excites quasiparticles with velocities both in the basal plane and in the c direction. Our data down to T_{c}/30 and down to H_{c2}/100 show no evidence that the nodes are in fact deep minima. Relative to the normal state, the thermal conductivity of the superconducting state is found to be very similar for the two current directions, from H=0 to H=H_{c2}. These findings show that the gap structure of Sr_{2}RuO_{4} consists of vertical line nodes. This rules out a chiral d-wave state. Given that the c-axis dispersion (warping of the Fermi surface in Sr_{2}RuO_{4} varies strongly from sheet to sheet, the small a-c anisotropy suggests that the line nodes are present on all three sheets of the Fermi surface. If imposed by symmetry, vertical line nodes would be inconsistent with a p-wave order parameter for Sr_{2}RuO_{4}. To reconcile the gap structure

Density functional theory study of the mechanism of Li diffusion in rutile RuO2

International Nuclear Information System (INIS)

Jung, Jongboo; Cho, Maenghyo; Zhou, Min

2014-01-01

First-principle calculations are carried out to study the diffusion of Li ions in rutile structure RuO 2 , a material for positive electrodes in rechargeable Li ion batteries. The calculations focus on migration pathways and energy barriers for diffusion in Li-poor and Li-rich phases using the Nudged Elastic Band Method. Diffusion coefficients estimated based on calculated energy barriers are in good agreement with experimental values reported in the literature. The results confirm the anisotropic nature of diffusion of Li ions in one-dimensional c channels along the [001] crystalline direction of rutile RuO 2 and show that Li diffusion in the Li-poor phase is faster than in the Li-rich phase. The findings of fast Li diffusion and feasible Li insertion at low temperatures in the host rutile RuO 2 suggest this material is a good ionic conductor for Li transport. The finding also suggests possible means for enhancing the performance of RuO 2 -based electrode materials

Photoelectrochemical water splitting for hydrogen production using combination of CIGS2 solar cell and RuO{sub 2} photocatalyst

Energy Technology Data Exchange (ETDEWEB)

Dhere, Neelkanth G. [University of Central Florida, Florida Solar Energy Center, 1679 Clearlake Road Cocoa, FL 32922-5703 (United States)]. E-mail: dhere@fsec.ucf.edu; Jahagirdar, Anant H. [University of Central Florida, Florida Solar Energy Center, 1679 Clearlake Road Cocoa, FL 32922-5703 (United States)

2005-06-01

This paper presents the development of photoelectrochemical (PEC) cell for water splitting setup using multiple band gap combination of CuIn{sub 1-x}Ga {sub x}S{sub 2} (CIGS2) thin-film photovoltaic (PV) cell and ruthenium oxide (RuO{sub 2}) photocatalyst. FSEC PV Materials Lab has developed a PEC setup consisting of two illuminated CIGS2 cells, a ruthenium oxide (RuO{sub 2}) anode deposited on titanium sheet for oxygen evolution and a platinum foil cathode for hydrogen evolution. With this combination, a PEC efficiency of 4.29% has been achieved. This paper also presents the research aimed at further improvements in the PEC efficiency by employing highly efficient photoanode that can be illuminated by photons not absorbed at the PV cell and by increasing the concentration of electrolyte solution (pH 10). The former will be achieved by employing a p-type transparent and conducting layer at the back of PV cell to transmit the unabsorbed photons, and the latter will reduce the resistance offered by the electrolyte. Concentration of the electrolyte was increased by five times, and the I-V characteristics of both RuO{sub 2} and RuS{sub 2} were measured with and without illumination. The results indicate that PEC efficiencies of over 9% can be achieved using RuS{sub 2} with illumination and five times concentrated pH 10 solution instead of pH 10 with normal concentration.

Structure and microstructure of hexagonal Ba3Ti2RuO9 by electron diffraction and microscopy

International Nuclear Information System (INIS)

Maunders, C.; Etheridge, J.; Whitfield, H.J.

2005-01-01

We have used electron microscopy and diffraction to refine the structure and investigate the microstructure of Ba 3 Ti 2 RuO 9 . The parent compound is hexagonal BaTiO 3 with the space group P6 3 /mmc. Using convergent-beam electron diffraction (CBED) combined with electron-sensitive image plates we have found that the space group of Ba 3 Ti 2 RuO 9 is the non-centrosymmetric group P6 3 mc. at room temperature and at ∝ 110 K. This is consistent with the Ru and Ti atoms occupying alternate face-sharing octahedral sites in the h0001i direction. This maintains the c-glide, but breaks the mirror normal to the c axis and consequently removes the centre of symmetry. Using powder X-ray diffraction, we have measured the lattice parameters from polycrystalline samples to be a = 5.7056 ± 0.0005, c = 14.0093 ± 0.0015 Aa at room temperature. Using high-resolution electron microscopy (HREM) we observed highly coherent, low-strain {10 anti 10} grain boundaries intersecting at 60 and 120 . From CBED we deduce that adjacent grains are identical but for the relative phase of the Ti and Ru atom ordering along the c axis. HREM also revealed occasional stacking faults, normal to the c-axis

Microstructure development in RuO2-glass thick-film resistors and its effect on the electrical resistivity

International Nuclear Information System (INIS)

Yamaguchi, T.; Iizuka, K.

1990-01-01

Microstructure development in RuO 2 -glass thick-film resistors has been studied by optical microscopy with special emphasis on the effect of glass particle size and mixing and firing conditions. The microstructure development has been characterized by the coalescence of glass grains, infiltration of glass into RuO 2 particle aggregates, and agglomeration of RuO 2 particles. The resistivity-firing temperature relationship has been correlated with the microstructure development

Lattice dynamical and thermodynamical properties of ReB2, RuB2, and OsB2 compounds in the ReB2 structure

International Nuclear Information System (INIS)

Deligoz, E.; Colakoglu, K.; Ciftci, Y. O.

2012-01-01

Structural and lattice dynamical properties of ReB 2 , RuB 2 , and OsB 2 in the ReB 2 structure are studied in the framework of density functional theory within the generalized gradient approximation. The present results show that these compounds are dynamically stable for the considered structure. The temperature-dependent behaviors of thermodynamical properties such as internal energy, free energy, entropy, and heat capacity are also presented. The obtained results are in good agreement with the available experimental and theoretical data

SiO2 decoration dramatically enhanced the stability of PtRu electrocatalysts with undetectable deterioration in fuel cell performance

Science.gov (United States)

Yu, Xinxin; Xu, Zejun; Yang, Zehui; Xu, Sen; Zhang, Quan; Ling, Ying; Zhang, Yunfeng; Cai, Weiwei

2018-06-01

Prevention of Ru dissolution is essential for steady CO tolerance of anodic electrocatalysts in direct methanol fuel cells. Here, we demonstrate a facile way to stabilize Ru atoms by decorating commercial CB/PtRu with SiO2, which shows a six-fold higher stability and similar activity toward a methanol oxidation reaction leading to no discernible degradation in fuel cell performance compared to commercial CB/PtRu electrocatalysts. The higher stability and stable CO tolerance of SiO2-decorated electrocatalysts originate from the SiO2 coating, since Ru atoms are partially ionized during SiO2 decorating, resulting in difficulties in dissolution; while, in the case of commercial CB/PtRu, the dissolved Ru offers active sites for Pt coalescences and CO species resulting in the rapid decay of the electrochemical surface area and fuel cell performance. To the best of our knowledge, this is the first study about the stabilization of Ru atoms by SiO2. The highest stability is obtained for a PtRu electrocatalyst with negligible effect on the electrochemical properties.

Ruthenium perovskites of type Ba/sub 2/BRuO/sub 6/ and Ba/sub 3/BRu/sub 2/O/sub 9/ with B = indium, rhodium

Energy Technology Data Exchange (ETDEWEB)

Schaller, H U; Kemmler-Sack, S [Tuebingen Univ. (Germany, F.R.). Lehrstuhl fuer Anorganische Chemie 2

1981-02-01

The black perovskites Ba/sub 2/InRu/sup 5 +/O/sub 6/ and Ba/sub 3/InRu/sub 2/O/sub 9/ (mean oxydation state of ruthenium: +4.5) adopt the hexagonal BaTiO/sub 3/ structure and form a continuous series of mixed crystals. According to the intensity calculations and analysis of the vibrational spectroscopic data an ordered distribution between indium and ruthenium is present: 1:1 order in Ba/sub 2/RuO/sub 6/ (space group P-3m1 respective Dsub(3d)/sup 3/; R' = 5.3%); 1:2 order in Ba/sub 3/InRu/sub 2/O/sub 9/ (space group P6/sub 3//mmc respective Dsub(6h)/sup 4/; R' = 4.6%). The corresponding black Rh compounds, Ba/sub 2/RhRuO/sub 6/ and Ba/sub 3/RhRu/sub 2/O/sub 9/, crystallize in the rhombohedral 9 L type of BaRuO/sub 3/ (author).

Atomic resolution observation of conversion-type anode RuO 2 during the first electrochemical lithiation

KAUST Repository

Mao, Minmin

2015-03-05

Transition metal oxides have attracted great interest as alternative anode materials for rechargeable lithium-ion batteries. Among them, ruthenium dioxide is considered to be a prototype material that reacts with the Li ions in the conversion type. In situ transmission electron microscopy reveals a two-step process during the initial lithiation of the RuO2 nanowire anode at atomic resolution. The first step is characterized by the formation of the intermediate phase LixRuO2 due to the Li-ion intercalation. The following step is manifested by the solid-state amorphization reaction driven by advancing the reaction front. The crystalline/amorphous interface is consisted of {011} atomic terraces, revealing the orientation-dependent mobility. In the crystalline matrix, lattice disturbance and dislocation are identified to be two major stress-induced distortions. The latter can be effective diffusion channels, facilitating transportation of the Li ions inside the bulk RuO2 crystal and further resulting in non-uniform Li-ion distribution. It is expected that the local enrichment of the Li ions may account for the homogeneous nucleation of dislocations in the bulk RuO2 crystal and the special island-like structures. These results elucidate the structural evolution and the phase transformation during electrochemical cycling, which sheds light on engineering RuO2 anode materials.

CeO2-ZrO2 ceramic compounds

International Nuclear Information System (INIS)

Melo, F.C.L.; Cairo, C.A.C.; Devezas, T.C.; Nono, M.C.A.

1988-01-01

In order to study the mechanical properties of tetragonal polycrystal zirconia stabilized with ceria various powder compositions with different CeO 2 content were made. Modulus of rupture for those compounds was measured. Tetragonal retained phase was determined for samples of CeO 2 -ZrO 2 ceramics with and without superficial mechanical treatment. The experimental results allowed us to evaluate the effects of CeO 2 content and sintering temperature in the mechanical properties and tetragonal transformed phase (t→ m) in ceramics of CeO 2 -ZrO 2 systems. (author) [pt

Electrical properties of thick-layer piezo resistors based on Bi2Ru2O7

International Nuclear Information System (INIS)

Golonka, L.; Tankiewicz, S.

1997-01-01

Piezoelectric effect and electrical properties of thick-layer resistors based on Bi 2 Ru 2 O 7 (on ceramic substrate) have been studied. The influence of selected technological parameters (sintering temperature, chemical composition, heat treatment) on system properties has been estimated. 4 refs, 7 figs

Galvanomagnetic properties of atomically disordered compounds YBa2Cu3O7

International Nuclear Information System (INIS)

Kar'kin, A.E.; Goshchitskij, B.N.

2001-01-01

To clarify the peculiarities of the metal-dielectric transition (MDT) in the HTSC type compounds one investigated into the galvanomagnetic properties of YBa 2 Cu 3 O 7 polycrystalline specimens irradiated by fast neutrons under 80 K temperature with F = 2x10 19 cm -2 fluence and subsequent to their exposure to the isochronal annealings within 150-390 K temperature range. It was determined that temperature dependences of R H Hall coefficient and of MR magnetic resistances of YBa 2 Cu 3 O 7 polycrystalline compounds disordered by fast neutrons retained the anomalous properties peculiar to the HTSC type disordered compounds in spite of the fact that conductivity was not a metallic one. This behavior is explained by the fact that in the disordered compounds there are two co-existing electron phases with conductivity as to the localized and the metallic states. Concentration of metallic phase is lower than threshold of passing, that is why, conductivity of this system is of dielectric type while R H and MR have temperature dependences similar to metallic phase that are renormalized by magnitude [ru

The key role of hydrogen by reaction behaviour on oxidic catalyst surface to RuO{sub 2}(110); Die Schluesselrolle des Wasserstoffs im Reaktionsverhalten einer oxidischen Katalysatoroberflaeche am Beispiel von RuO{sub 2}(110)

Energy Technology Data Exchange (ETDEWEB)

Knapp, M.

2006-05-15

In this work it is demonstrated that there are different ways to deactivate the RuO{sub 2}(110)- surface. All experiments were performed on Ru single-crystals under UHV-conditions by applying the surface science techniques including Low Energy Electron Diffraction (LEED), Thermal Desorption Spectroscopy (TDS), Scanning Tunnelling Microscopy (STM) and X-ray Photoelectron Spectroscopy (XPS). An active RuO{sub 2}(110) film was produced by exposing a well-prepared single crystal Ru(0001) surface to high doses of oxygen at elevated temperatures of 600-650 K. An alternative way to deactivate the RuO{sub 2}(110) surface was studied by adsorbing hydrogen. On the bare (stoichiometric) surface hydrogen adsorbs at room temperature dissociatively on the O{sub br} atoms forming hydroxyl groups. The hydroxyl groups are not active in the oxidation of CO. On the other hand the adsorption and desorption process of the CO molecule is not affected by the hydroxyl groups. Therefore it is possible to passivate only one kind of active sites on the RuO{sub 2}(110) surface. The hydroxyl groups are stable up to a temperature around 550 K. Above this temperature water is formed by the recombination of two neighboring OH groups and desorbs into the gas phase, leaving O-vacancies on the surface. To remove the hydrogen from the O{sub br} atoms at lower temperatures one needs to dose oxygen at 300 K. Water molecules are immediately formed on the 1f-cus-Ru atoms and desorb at about 400 K into the gas phase. After this oxidation step the surface is restored. The reason for this behaviour is a hydrogen transfer reaction on the surface: The hydrogen is initially located on the O{sub br} sites whereas the subsequently dosed oxygen adsorbs atomically on the 1f-cus-Ru forming on-topoxygen (O{sub ot}). This O{sub ot} picks up the hydrogen from the O{sub br} and forms water molecules. The hydrogen transfer reaction plays a key role in the interaction of hydrogen with the RuO{sub 2}(110) surface. By

Water quality assessment by an integrated multi-sensor based on semiconductor RuO2 nanostructures

International Nuclear Information System (INIS)

Zhuiykov, Serge; O'Brien, David; Best, Michael

2009-01-01

A multi-sensor based on a nanostructured semiconductor ruthenium oxide (RuO 2 ) sensing electrode (RuO 2 -SE) deposited on an alumina substrate and capable of being coupled with a simple turbidity sensor has been evaluated for long-term pH stability during a 12-month non-stop trial. The multi-sensor is designed to detect the main parameters of water quality: pH, dissolved oxygen (DO), temperature, conductivity and turbidity over a temperature range of 9–30 °C. The morphology of the film SE used in the sensor structure was investigated by scanning electron microscopy and energy dispersive x-ray-analysis at the beginning of the trial and after 12 months of service. It was found that both morphology and surface compositions of nanostructured RuO 2 -SEs did not change significantly. They keep their high sensitivity to adsorption of superoxide ions (O 2 − ) despite heavy depositions of bio-fouling. The sensors with a RuO 2 -SE have demonstrated a stable Nernstian response to pH from 2.0 to 13.0 and were also capable of measuring DO in the range of 0.6–8.0 ppm. The measurement results show very good linearity, and excellent reproducibility was obtained during the trial. The Nernstian slope was approximately 58 mV pH −1 at a temperature of 23 °C. Although RuO 2 -SEs have been shown to exhibit very good response time for pH changes, within a few seconds at a temperature of 23 °C, as the water temperature cooled down, the sensor response time increased significantly and was about 8–10 min or longer at a temperature of 9 °C. The influence of hydrogen ion (H + ) diffusion in nanostructured RuO 2 films on the output emf drift during pH measurements was also investigated. Additional turbidity and conductivity measurements revealed that the multi-sensor is capable of measuring both high and low ranges at different temperatures, exhibiting a high linearity of characteristics

Light Makes a Surface Banana-Bond Split: Photodesorption of Molecular Hydrogen from RuO ₂ (110)

Energy Technology Data Exchange (ETDEWEB)

Henderson, Michael A.; Mu, Rentao; Dahal, Arjun; Lyubinetsky, Igor; Dohnálek, Zdenek; Glezakou, Vassiliki-Alexandra; Rousseau, Roger

2016-07-20

The coordination of H2 to a metal center via polarization of its bond electron density, known as a Kubas complex, is the means by which H2 chemisorbs at Ru4+ sites on the rutile RuO2(110) surface. This distortion of electron density off an interatomic axis is often described as a ‘banana-bond.’ We show that the Ru-H2 banana-bond can be destabilized, and split, using visible light. Photodesorption of H2 (or D2) is evident by mass spectrometry and scanning tunneling microscopy. From time-dependent density functional theory, the key optical excitation splitting the Ru-H2 banana-bond involves an interband transition in RuO2 which effectively diminishes its Lewis acidity, and thereby weakening the Kubas complex. Such excitations are not expected to affect adsorbates on RuO2 given its metallic properties. Therefore, this common thermal co-catalyst employed in promoting water splitting is, itself, photo-active in the visible.

1-O-Acetyl-3,4,6-tri-O-benzyl-2-C-bromomethyl-2-deoxy-α-d-glucopyranose

Directory of Open Access Journals (Sweden)

Henok H. Kinfe

2013-01-01

Full Text Available In the title compound, C30H33BrO6, the pyranose ring adopts a chair conformation. Two of the O-benzyl phenyl rings lie almost perpendicular to C/C/C/O plane formed by the ring atoms not attached to these O-benzyl phenyl rings, and form dihedral angles of 85.1 (2 and 64.6 (2°, while the third O-benzyl phenyl ring is twisted so that it makes a dihedral angle 34.9 (2° to this C/C/C/O plane. This twist is ascribed to the formation of an S(8 loop stabilized by a weak intramolecular C—H...O hydrogen bond.

Two new three-dimensional zinc phosphites templated by piperazine: [H2pip][Zn3(HPO3)4(H2O)2] and K[H2pip]0.5[Zn3(HPO3)4

Science.gov (United States)

Zhang, Xiao; Wang, Guo-Ming; Wang, Zong-Hua; Wang, Ying-Xia; Lin, Jian-Hua

2014-01-01

Two three-dimensional open-framework zinc phosphites with the same organically templated, [H2pip][Zn3(HPO3)4(H2O)2] (1) and K[H2pip]0.5[Zn3(HPO3)4] (2) (pip = piperazine), have been solvothermally synthesized and structurally characterized by IR, elemental analysis, thermogravimetric analysis, powder and single-crystal X-ray diffractions. Compound 1 consists of ZnO4 tetrahedra, [HPO3] pseudopyramids and [ZnO4(H2O)2] octahedra, which are linked through their vertexes to generate three-dimensional architecture with intersecting 8-membered channels along the [1 0 0], [0 0 1] and [1 0 1] directions. Compound 2 is constructed from strictly alternating ZnO4 tetrahedra and [HPO3] pseudopyramids, and exhibits (3,4)-connected inorganic framework with 8-, and 12-membered channels, in which the K+ and diprotonated H2pip2+ extra-framework cations reside, respectively. The coexistence of inorganic K+ and organic piperazine mixed templates in the structure is unique and, to the best of our knowledge, firstly observed in metal-phosphite materials. In addition, the participation of left-handed and right-handed helical chains in construction of the puckered 4.82 sheet structure in 2 is also noteworthy.

Electrical conductivity of oxides from molten state to glassy. Effect on the incorporation of RuO{sub 2} particles; Conductivite electrique des verres et fontes d'oxides. Effets de l'incorporation de particules RuO{sub 2}

Energy Technology Data Exchange (ETDEWEB)

Simonnet, C

2004-07-01

This study concerns the electrical conductivity of oxides from molten state to glassy state and, in particular, the effect of the incorporation of RuO{sub 2} particles in the context of vitrification of radioactive waste. The material of interest in the nuclear field is basically a viscous or vitreous borosilicate containing a dispersion of RuO{sub 2} microcrystals. A very simple model of this heterogeneous material has been studied in particular (SiO{sub 2}, B{sub 2}O{sub 3}, Na{sub 2}O, RuO{sub 2}). An original method of impedance measurement in the liquid at high temperature yields reliable electrical conductivity values over a temperature range covering the liquid and vitreous phases of the borosilicates studied. In the borosilicate matrix, alkaline transport is mainly responsible for the ionic conduction. The temperature dependence of the conductivity may thus be represented by an equation combining a VFT law and an Arrhenius law to represent the electrical conductivity above and below T{sub g}. Beyond a critical volume fraction V{sub c} {approx} 0.01 of RuO{sub 2}, an electronic contribution is added to the ionic contribution of the matrix and the electrical conductivity increases significantly with the RuO{sub 2} content. This effect is described in terms of electrical percolation of the particle network. An electronic mechanism by tunnel transfer between particles is demonstrated. A mathematical model is developed to describe this mechanism in the solid composite. Beyond T{sub g}, conduction by the tunnel effect persists and the partial solubilization of RuO{sub 2} appears to be mainly responsible for the significant increase in electronic conductivity with the temperature. (author)

Formation and nitrile hydrogenation performance of Ru nanoparticles on a K-doped Al2O3 surface.

Science.gov (United States)

Muratsugu, Satoshi; Kityakarn, Sutasinee; Wang, Fei; Ishiguro, Nozomu; Kamachi, Takashi; Yoshizawa, Kazunari; Sekizawa, Oki; Uruga, Tomoya; Tada, Mizuki

2015-10-14

Decarbonylation-promoted Ru nanoparticle formation from Ru3(CO)12 on a basic K-doped Al2O3 surface was investigated by in situ FT-IR and in situ XAFS. Supported Ru3(CO)12 clusters on K-doped Al2O3 were converted stepwise to Ru nanoparticles, which catalyzed the selective hydrogenation of nitriles to the corresponding primary amines via initial decarbonylation, the nucleation of the Ru cluster core, and the growth of metallic Ru nanoparticles on the surface. As a result, small Ru nanoparticles, with an average diameter of less than 2 nm, were formed on the support and acted as efficient catalysts for nitrile hydrogenation at 343 K under hydrogen at atmospheric pressure. The structure and catalytic performance of Ru catalysts depended strongly on the type of oxide support, and the K-doped Al2O3 support acted as a good oxide for the selective nitrile hydrogenation without basic additives like ammonia. The activation of nitriles on the modelled Ru catalyst was also investigated by DFT calculations, and the adsorption structure of a nitrene-like intermediate, which was favourable for high primary amine selectivity, was the most stable structure on Ru compared with other intermediate structures.

Magnetoelastic coupling in multiferroic GdMnO{sub 3} and metamagnetic Ca{sub 2-x}Sr{sub x}RuO{sub 4}; Magnetoelastische Kopplung in multiferroischem GdMnO{sub 3} und metamagnetischem Ca{sub 2-x}Sr{sub x}RuO{sub 4}

Energy Technology Data Exchange (ETDEWEB)

Baier, J.

2006-05-15

Subject of the present thesis is the magnetoelastic coupling in multiferroic GdMnO{sub 3} and the metamagnetic Ca{sub 2-x}Sr{sub x}RuO{sub 4} with x between 0.2 and 0.5. GdMnO{sub 3} belongs to a class of new multiferroic materials where ferroelectricity shows up inside a magnetically ordered phase and a strong coupling between the magnetic and the electric properties is present. It possesses two magnetic transitions, one at T{sub N} into the ICAFM phase and one at T{sub c} into the cAFM phase. Furthermore, for H parallel b, a ferroelectric transition occurs at T{sub FE}. Based on thermal-expansion and magnetostriction data, a modified H-T-phase diagram is derived. Due to large hysteresis effects in the low-field and low-temperature region, the pure cAFM phase cannot be reached upon cooling in zero magnetic field. The transition into the cAFM phase is accompanied by a jumplike drop of the orthorhombic splitting, which recovers upon entering the ferroelectric phase. Moreover, the uniaxial pressure dependencies of all three transitions are analysed. For the compound Ca{sub 2-x}Sr{sub x}RuO{sub 4} a change of the relevant magnetic correlation from ferromagnetic to antiferromagnetic is observed as soon as the RuO{sub 6} octahedra start tilting upon decreasing the Sr content below x=0.5. In Ca{sub 1.8}Sr{sub 0.2}RuO{sub 4}, a metamagnetic transition occurs in a magnetic field, which comes along with strong structural changes. However, a complete suppression of the tilt upon the magnetic-field induced crossover from antiferromagnetic to ferromagnetic correlations can be excluded. At low temperatures, strong and anisotropic thermal expansion anomalies are observed. Both, these anomalies and the structural changes at the metamagnetic transition point towards a rearrangement of the orbital occupation induced by temperature as well as by magnetic field. For Ca{sub 1.8}Sr{sub 0.2}RuO{sub 4}, a sign change of the low-temperature anomalies of the thermal expansion and the

(E-3-(4-Bromophenyl-1-(3,4-dichlorophenylprop-2-en-1-one

Directory of Open Access Journals (Sweden)

Rajni Kant

2009-04-01

Full Text Available The molecule of the title compound, C15H9BrCl2O, is shown to be the E isomer, with the 3,4-dichlorobenzoyl and p-bromophenyl substituents in trans positions with respect to the chalcone olefin bond. The molecule is non-planar, the two aromatic rings forming a dihedral angle of 49.58 (1°.

Ethanol electrooxidation using Ti/(RuO2)(x) Pt(1-x) electrodes prepared by the polymeric precursor method

Energy Technology Data Exchange (ETDEWEB)

Freitas, R.G.; Marchesi, L.F.Q.P.; Forim, M.R.; Pereira, E.C. [Departamento de Quimica, Universidade Federal de Sao Carlos, Sao Carlos, SP (Brazil); Bulhoes, L.O.S [CENIP, Centro Universitario Central Paulista, Sao Carlos, SP (Brazil); Santos, M.C. [LEMN, Centro de Ciencias Naturais e Humanas, Universidade Federal do ABC, Santo Andre, SP (Brazil); Oliveira, R.T.S., E-mail: robson@icbn.uftm.edu.br [Instituto de Ciencias Biologicas e Naturais, Universidade Federal do Triangulo Mineiro, Uberaba, MG (Brazil)

2011-09-15

This work describes a detailed study of the ethanol electrooxidation on Ti/(RuO{sub 2}){sub (x)}Pt{sub (1-x)} electrodes using several compositions prepared by the polymeric precursor method. The results obtained using cyclic voltammetry and chronoamperometry showed that the best composition of Ti/(RuO{sub 2}){sub (x)}Pt{sub (1-x)} electrodes for CO and ethanol oxidation processes is Ti/(RuO{sub 2}){sub 0.50}Pt{sub 0.50}. On this electrode composition the onset of CO and the ethanol oxidation occurred at 380 mV and 220 mV more negative than on Ti/Pt, respectively. Besides, there was an increase of 2.5-fold in the current density for ethanol electrooxidation under constant potential polarization. The Ti/(RuO{sub 2}){sub 0.50}Pt{sub 0.50}. electrodes produced lower amount of acetic acid compared to Ti/Pt and polycrystalline Pt electrodes using in situ HPLC spectrometric analysis. Also, a non common product from ethanol oxidation could be observed on higher RuO{sub 2} loads: ethyl acetate. Finally, the impedance data showed that Ti/(RuO{sub 2}){sub 0.50}Pt{sub 0.50}. electrode composition had the smallest charge transfer resistance for ethanol oxidation among those compositions investigated. (author)

Synthesis, characterisation and antibacterial activity of [(p-cym)RuX(L)](+/2+) (X = Cl, H2O; L = bpmo, bpms) complexes.

Science.gov (United States)

Tripathy, Suman Kumar; Taviti, Ashoka Chary; Dehury, Niranjan; Sahoo, Anupam; Pal, Satyanaryan; Beuria, Tushar Kant; Patra, Srikanta

2015-03-21

Mononuclear half-sandwiched complexes [(p-cym)RuCl(bpmo)](ClO4) {[1](ClO4)} and [(p-cym)RuCl(bpms)](PF6) {[2](PF6)} have been prepared by reacting heteroscorpionate ligands bpmo = 2-methoxyphenyl-bis(3,5-dimethylpyrazol-1-yl)methane and bpms = 2-methylthiophenyl-bis(3,5-dimethylpyrazol-1-yl)methane, respectively, with a dimeric precursor complex [(p-cym)RuCl(μ-Cl)]2 (p-cym = 1-isopropyl-4-methylbenzene) in methanol. The corresponding aqua derivatives [(p-cym)Ru(H2O)(bpmo)](ClO4)2 {[3](ClO4)2} and [(p-cym)Ru(H2O)(bpms)](PF6)2 {[4](PF6)2} are obtained from {[1](ClO4)} and {[2](PF6)}, respectively, via Cl(-)/H2O exchange process in the presence of appropriate equivalents of AgClO4/AgNO3 + KPF6 in a methanol-water mixture. The molecular structures of the complexes {[1]Cl, [3](ClO4)2 and [4](PF6)(NO3)} are authenticated by their single crystal X-ray structures. The complexes show the expected piano-stool geometry with p-cym in the η(6) binding mode. The aqua complexes [3](ClO4)2 and [4](PF6)2 show significantly good antibacterial activity towards E. coli (gram negative) and B. subtilis (gram positive) strains, while chloro derivatives ({[1](ClO4)} and {[2](PF6)} are found to be virtually inactive. The order of antibacterial activity of the complexes according to their MIC values is [1](ClO4) (both 1000 μg mL(-1)) < [2](PF6) (580 μg mL(-1) and 750 μg mL(-1)) < [3](ClO4)2 (both 100 μg mL(-1)) < [4](PF6)2 (30 μg mL(-1) and 60 μg mL(-1)) for E. coli and B. subtilis strains, respectively. Further, the aqua complexes [3](ClO4)2 and [4](PF6)2 show clear zones of inhibition against kanamycin, ampicillin and chloramphenicol resistant E. coli strains. The detailed mechanistic aspects of the aforesaid active aqua complexes [3](ClO4)2 and [4](PF6)2 have been explored, and it reveals that both the complexes inhibit the number of nucleoids per cell in vivo and bind to DNA in vitro. The results indeed demonstrate that both [3](ClO4)2 and [4](PF6)2 facilitate the inhibition of

catena-Poly[[[triaqua[3-(4-carboxyphenoxyphthalato-κO2]manganese(II]-μ-4,4′-bipyridine-κ2N:N′] 4,4′-bipyridine monosolvate dihydrate

Directory of Open Access Journals (Sweden)

Wei Sun

2013-02-01

Full Text Available In the title compound, {[Mn(C15H8O7(C10H8N2(H2O3]·C10H8N2·2H2O}n, the bridging mode of the coordinating 4,4′-bipyridine ligands leads to the formation of polymeric zigzag chains parallel to [0-11]. The chains are separated by 4,4′-bipyridine and water solvent molecules. Within a chain, the MnII atom is six-coordinated by two N atoms of the bridging 4,4′-bipyridine ligands, three water O atoms and one carboxylate O atom of a single deprotonated 3-(4-carboxyphenoxyphthalic acid ligand. Both coordinating and solvent 4,4′-bipyridine molecules are situated on centres of inversion. An intricate network of O—H...O and O—H...N hydrogen bonds involving the carboxy group, the coordinating water molecules and the two types of solvent molecules leads to the formation of a three-dimensional network.

Toward selective electrochemical 'E-tongue': Potentiometric DO sensor based on sub-micron ZnO-RuO{sub 2} sensing electrode

Energy Technology Data Exchange (ETDEWEB)

Zhuiykov, Serge, E-mail: serge.zhuiykov@csiro.au [CSIRO, Materials Science and Engineering Division, 37 Graham Road, Highett, VIC 3190 (Australia); Kats, Eugene [CSIRO, Materials Science and Engineering Division, 37 Graham Road, Highett, VIC 3190 (Australia); Plashnitsa, Vladimir [Research and Education Centre of Carbon Resources, Kyushu University, Kasuga-shi, Fukuoka 816-8580 (Japan); Miura, Norio [KASTEC, Kyushu University, Kasuga-shi, Fukuoka 816-8580 (Japan)

2011-06-01

Highlights: > We examine ZnO-doped RuO{sub 2} sensing electrode of DO sensor. > Study of ZnO-RuO{sub 2} confirmed the development of high surface-to-volume ratio. > Developed sensing electrode is insensitive to the presence of various dissolved salts. > 20 mol% ZnO-doped RuO{sub 2} sensing electrode enables maximum DO sensitivity. > We conclude that DO sensor based on ZnO-RuO{sub 2} electrode can work at 11-30 deg. C. - Abstract: Planar dissolved oxygen (DO) sensors based on thick-film ZnO-RuO{sub 2} sensing electrodes (SEs) with different mol% of ZnO were prepared on the alumina substrates using a screen-printing method and their structural and electrochemical properties were closely studied by X-ray diffraction (XRD), Fourier transform infrared spectroscopy (FTIR), scanning electron microscopy (SEM), energy-dispersive X-ray analysis (EDX), electrochemical impedance spectroscopy (EIS) and energy-dispersive spectroscopy (EDS) techniques. Structural and electrochemical properties of ZnO-RuO{sub 2}-SEs have been investigated. Interference testing ascertained that the DO sensor based on sub-micron ZnO-RuO{sub 2}-SE is insensitive to the presence of various dissolved ions including Cl{sup -}, Li{sup +}, SO{sub 4}{sup 2-}, NO{sup 3-}, Ca{sup 2+}, PO{sub 4}{sup 3-}, Mg{sup 2+}, Na{sup +} and K{sup +} within a concentration range of 10{sup -7} to 10{sup -1} mol/L for DO measurement from 0.5 to 8.0 ppm in the test solution at a temperature range of 11-30 deg. C. These dissolved salts had practically no effect on the sensor's output potential difference response, whereas Br{sup -} ions had some effects at concentration more than 10{sup -3} mol/L. The relationship between DO and the sensor's potential difference was found to be relatively linear with the maximum sensitivity of -50.6 mV per decade was achieved at 20 mol% ZnO at 7.35 pH. The response and recovery time to pH changes for the planar device based on 20 mol% ZnO-RuO{sub 2}-SE was found to be 10 and 25 s

Formation of heavy d-electron quasiparticles in Sr3Ru2O7

International Nuclear Information System (INIS)

Allan, M P; Tamai, A; Rozbicki, E; King, P D C; Meevasana, W; Perry, R S; Mercure, J F; Mackenzie, A P; Fischer, M H; Wang, M A; Lee, Jinho; Kim, E-A; Lawler, M J; Shen, K M; Voss, J; Fennie, C J; Thirupathaiah, S; Rienks, E; Fink, J; Tennant, D A

2013-01-01

The phase diagram of Sr 3 Ru 2 O 7 shows hallmarks of strong electron correlations despite the modest Coulomb interaction in the Ru 4d shell. We use angle-resolved photoelectron spectroscopy measurements to provide microscopic insight into the formation of the strongly renormalized heavy d-electron liquid that controls the physics of Sr 3 Ru 2 O 7 . Our data reveal itinerant Ru 4d-states confined over large parts of the Brillouin zone to an energy range of <6 meV, nearly three orders of magnitude lower than the bare band width. We show that this energy scale agrees quantitatively with a characteristic thermodynamic energy scale associated with quantum criticality and illustrate how it arises from a combination of back-folding due to a structural distortion and the hybridization of light and strongly renormalized, heavy quasiparticle bands. The resulting heavy Fermi liquid has a marked k-dependence of the renormalization which we relate to orbital mixing along individual Fermi surface sheets. (paper)

Tetrakis(6-methyl-2,2′-bipyridine-1κ2N,N′;2κ2N,N′;3κ2N,N′;4κ2N,N′-tetra-μ-nitrato-1:2κ2O:O′;2:3κ3O:O′,O′′;2:3κ3O,O′:O′′;3:4κ2O:O′-tetranitrato-1κ4O,O′;4κ2O,O′-tetralead(II

Directory of Open Access Journals (Sweden)

Roya Ahmadi

2009-10-01

Full Text Available In the tetranuclear centrosymmetric title compound, [Pb4(NO38(C11H10N24], irregular PbN2O5 and PbN2O4 coordination polyhedra occur. The heptacoordinated lead(II ion is bonded to two bidentate and one monodentate nitrate ion and one bidentate 6-methyl-2,2′-bipyridine (mbpy ligand. The six-coordinate lead(II ion is bonded to one bidentate and two monodentate nitrate anions and one mbpy ligand. In the crystal, bridging nitrate anions lead to infinite chains propagating in [111]. A number of C—H...O hydrogen bonds may stabilize the structure.

The effect of CF4 addition on Ru etching with inductively coupled plasma

International Nuclear Information System (INIS)

Lim, Kyu Tae; Kim, Dong Pyo; Kim, Kyoung Tae; Kim, Chang Il

2003-01-01

Ru thin films were etched in CF 4 /O 2 plasma using an ICP (inductively coupled plasma etching) system. The etch rate of Ru thin films was examined as a function of gas mixing ratio. The maximum etch rate of Ru thin films was 168 nm/min at a CF 4 /O 2 gas mixing ratio of 10 %. The selectivity of Ru over SiO 2 was 1.3. From the OES (optical emission spectroscopy), the optical emission intensity of the O radical had a maximum value at 10 % of CF 4 gas concentration and decrease with further addition of CF 4 gas. From XPS (x-ray photoelectron spectroscopy) analysis, Ru-F bonds by the chemical reaction of Ru and F appeared in the surface of the etched Ru thin film in CF 4 /O 2 chemistry. RuF 3-4 compounds were suggested as a surface passivation layer that reduces the chemical reactions between Ru and O radicals. In a FE-SEM (field emission scanning electron microscope) micrograph, we had an almost perpendicular taper angle of 89 .deg.

Electrodeposition of Ru in TiO{sub 2} nanotubes: increase of photocatalytical activity and identification of deposition route; Eletrodeposicao de Ru em nanotubos de TiO{sub 2}: aumento da atividade fotocatalitica e identificacao da rota de deposicao

Energy Technology Data Exchange (ETDEWEB)

Castelhano, Douglas Iafrate; Rodrigues, Christiane de Arruda, E-mail: douglas_iafrate@yahoo.com.br [Universidade Federal de Sao Paulo (UNIFESP), Diadema, SP (Brazil). Departamento de Ciencias Exatas e da Terra; Bertazzoli, Rodnei [Universidade Estadual de Campinas (UNICAMP), SP (Brazil). Departamento de Engenharia de Materiais

2014-07-01

TiO2 nanotubes are semiconductors widely used in heterogeneous photocatalysis processes. It has a band gap energy (E{sub bg}) of 3,2 eV and an photoactive crystalline structure (anatase). To increase the photocatalytic activity of this oxide, by lowering the Ebg and reduction of charge recombination rate, a modification of oxide crystalline layer was made with ruthenium, using electrochemical deposition at constant potential. TiO{sub 2} layer was made by anodization process at 20V, followed by thermic treatment in 450 deg C and electrodeposition of Ru at constant potential. Voltammetric studies showed that Ru electrodeposition occurs in two stages, and in the second stage is the deposition of metallic Ru. Photocurrent studies showed that the amount of Ru in the oxide layer varies according with the applied potential and a significant increase of semiconductor activity is obtained with the introduction of small quantities of Ru, increasing at least 70% in current values. Morphological and crystallinity analysis were made using SEM and XRD. To identify and quantify Ru in TiO{sub 2} was used WDS. (author)

(4S)-4-(3,4-Dichloro?phen?yl)-1?-methyl-4?-phenyl-3,4-dihydronaphthalene-2-spiro-3?-pyrrolidine-2?-spiro-1??-acenaphthyl?ene-1,2??(2H,1??H)-dione

OpenAIRE

Murugan, R.; Gunasekaran, B.; Narayanan, S. Sriman; Manivannan, V.

2008-01-01

In the title compound, C37H27Cl2NO2, the 3,4-dichloro?phenyl ring makes a dihedral angle of 46.66?(6)? with the phenyl ring. The mol?ecular structure is stabilized by weak intra?molecular C?H?O inter?actions and the crystal structure is stabilized by weak inter?molecular C?H?O inter?actions. The C?C?C?C?C five-membered ring is planar, while the C?C?C?C?N five-membered ring adopts a half-chair conformation.

The effect of hydrogen absorption on the structural, electronic and magnetic properties of the C15 Friauf-Laves phase compounds CeFe2, CeRu2 and LaRu2 : an x-ray absorption spectroscopy (XAS) study

International Nuclear Information System (INIS)

Chaboy, J.; Garcia, J.; Marcelli, A.

1995-08-01

An x-ray absorption spectroscopy (XAS) investigation of the structural changes occurred upon hydriding in the Friauf-Laves phase compounds CeFe 2 , CeRu 2 and LaRu 2 compounds is presented. The analysis of the extended x-ray absorption spectroscopy (EXAFS) spectra at the L-edges of the rare-earth and at the Fe K-edge indicates that the hydrogenation process leads to the suppression of the long-range crystalline order in all the hydride derivates investigated, as well as the different influence of H 2 in both the rare earth and transition metal sublattices. The correlation between the structural and magnetic changes induced by the hydrogen in the lost matrix is discussed in terms of the modification of the electronic properties, i.e., intermediate-valence of Ce, and of the hybridization between the transition metal and rare-earth

Phosphinodi(benzylsilane) PhP{(o-C6H4CH2)SiMe2H}2: a versatile "PSi2Hx" pincer-type ligand at ruthenium.

Science.gov (United States)

Montiel-Palma, Virginia; Muñoz-Hernández, Miguel A; Cuevas-Chávez, Cynthia A; Vendier, Laure; Grellier, Mary; Sabo-Etienne, Sylviane

2013-09-03

The synthesis of the new phosphinodi(benzylsilane) compound PhP{(o-C6H4CH2)SiMe2H}2 (1) is achieved in a one-pot reaction from the corresponding phenylbis(o-tolylphosphine). Compound 1 acts as a pincer-type ligand capable of adopting different coordination modes at Ru through different extents of Si-H bond activation as demonstrated by a combination of X-ray diffraction analysis, density functional theory calculations, and multinuclear NMR spectroscopy. Reaction of 1 with RuH2(H2)2(PCy3)2 (2) yields quantitatively [RuH2{[η(2)-(HSiMe2)-CH2-o-C6H4]2PPh}(PCy3)] (3), a complex stabilized by two rare high order ε-agostic Si-H bonds and involved in terminal hydride/η(2)-Si-H exchange processes. A small free energy of reaction (ΔrG298 = +16.9 kJ mol(-1)) was computed for dihydrogen loss from 3 with concomitant formation of the 16-electron species [RuH{[η(2)-(HSiMe2)-CH2-o-C6H4]PPh[CH2-o-C6H4SiMe2]}(PCy3)] (4). Complex 4 features an unprecedented (29)Si NMR decoalescence process. The dehydrogenation process is fully reversible under standard conditions (1 bar, 298 K).

Heat capacity measurements of Sr{sub 2}RuO{sub 4} under uni-axial strain

Energy Technology Data Exchange (ETDEWEB)

Li, You-sheng; Mackenzie, Andrew [Max Planck Institute for Chemical Physics of Solids, Dresden (Germany); University of St. Andrews, School of Physics and Astronomy (United Kingdom); Gibbs, Alexandra [Max Planck Institute for Solid State Research, Stuttgart (Germany); Hicks, Clifford [Max Planck Institute for Chemical Physics of Solids, Dresden (Germany); Nicklas, Michael [University of St. Andrews, School of Physics and Astronomy (United Kingdom)

2016-07-01

One of the most-discussed possible pairing symmetries of Sr{sub 2}RuO{sub 4} is p{sub x} ± ip{sub y}. By applying strain along left angle 100 right angle -direction, the degeneracy of the p{sub x} and p{sub y} components is lifted, and thus there should be two critical temperatures (T{sub c}). Hicks et al. have observed an increase of T{sub c} of Sr{sub 2}RuO{sub 4} under both compressive and tensile strains, by measuring the susceptibility, which is sensitive only to the first transition. Their results also indicate, indirectly, that any splitting of T{sub c}s might be small. For a direct test of possible splitting, we measure the heat capacity of Sr{sub 2}RuO{sub 4} under strain. To do so, we are developing an approach to measure heat capacity under non-adiabatic conditions. We have observed an increase of T{sub c} under compressive strain. This is the first thermodynamic evidence of the strain-induced increase in T{sub c} of Sr{sub 2}RuO{sub 4}.

Crystal structure of [(2R,3R,4S)-3,4-bis(acet-yloxy)-5-iodo-3,4-di-hydro-2H-pyran-2-yl]methyl acetate.

Science.gov (United States)

Zukerman-Schpector, Julio; Caracelli, Ignez; Stefani, Hélio A; Shamim, Anwar; Tiekink, Edward R T

2015-01-01

In the title compound, C12H15IO7, the 3,4-di-hydro-2H-pyran ring is in a distorted half-boat conformation with the atom bearing the acet-yloxy group adjacent to the C atom bearing the methyl-acetate group lying 0.633 (6) Å above the plane of the remaining ring atoms (r.m.s. deviation = 0.0907 Å). In the crystal, mol-ecules are linked into a supra-molecular chain along the a axis through two C-H⋯O inter-actions to the same acceptor carbonyl O atom; these chains pack with no specific inter-molecular inter-actions between them.

Enhanced rate performance of mesoporous Co3O4 nanosheet supercapacitor electrodes by hydrous RuO2 nanoparticle decoration

KAUST Repository

Baby, Rakhi Raghavan

2014-03-26

Mesoporous cobalt oxide (Co3O4) nanosheet electrode arrays are directly grown over flexible carbon paper substrates using an economical and scalable two-step process for supercapacitor applications. The interconnected nanosheet arrays form a three-dimensional network with exceptional supercapacitor performance in standard two electrode configuration. Dramatic improvement in the rate capacity of the Co3O4 nanosheets is achieved by electrodeposition of nanocrystalline, hydrous RuO 2 nanoparticles dispersed on the Co3O4 nanosheets. An optimum RuO2 electrodeposition time is found to result in the best supercapacitor performance, where the controlled morphology of the electrode provides a balance between good conductivity and efficient electrolyte access to the RuO2 nanoparticles. An excellent specific capacitance of 905 F/g at 1 A/g is obtained, and a nearly constant rate performance of 78% is achieved at current density ranging from 1 to 40 A/g. The sample could retain more than 96% of its maximum capacitance even after 5000 continuous charge-discharge cycles at a constant high current density of 10 A/g. Thicker RuO2 coating, while maintaining good conductivity, results in agglomeration, decreasing electrolyte access to active material and hence the capacitive performance. © 2014 American Chemical Society.

Electrodeposition of Ru in TiO_2 nanotubes: increase of photocatalytical activity and identification of deposition route

International Nuclear Information System (INIS)

Castelhano, Douglas Iafrate; Rodrigues, Christiane de Arruda; Bertazzoli, Rodnei

2014-01-01

TiO2 nanotubes are semiconductors widely used in heterogeneous photocatalysis processes. It has a band gap energy (E_b_g) of 3,2 eV and an photoactive crystalline structure (anatase). To increase the photocatalytic activity of this oxide, by lowering the Ebg and reduction of charge recombination rate, a modification of oxide crystalline layer was made with ruthenium, using electrochemical deposition at constant potential. TiO_2 layer was made by anodization process at 20V, followed by thermic treatment in 450 deg C and electrodeposition of Ru at constant potential. Voltammetric studies showed that Ru electrodeposition occurs in two stages, and in the second stage is the deposition of metallic Ru. Photocurrent studies showed that the amount of Ru in the oxide layer varies according with the applied potential and a significant increase of semiconductor activity is obtained with the introduction of small quantities of Ru, increasing at least 70% in current values. Morphological and crystallinity analysis were made using SEM and XRD. To identify and quantify Ru in TiO_2 was used WDS. (author)

Variable dimensionality and framework found in a series of quaternary zinc selenites, A2Zn3(SeO3)4·xH2O (A = Na, Rb, and Cs; 0≤x≤1) and Cs2Zn2(SeO3)3·2H2O

Science.gov (United States)

Lü, Minfeng; Jo, Hongil; Oh, Seung-Jin; Ok, Kang Min

2017-01-01

Five new alkali metal zinc selenites, A2Zn3(SeO3)4·xH2O (A = Na, Rb, and Cs; 0≤x≤1) and Cs2Zn2(SeO3)3·2H2O have been synthesized by heating a mixture of ZnO, SeO2 and A2CO3 (A = Na, Rb, and Cs), and characterized by X-ray diffraction (XRD) and spectroscopic analyses techniques. All of the reported materials revealed a rich structural chemistry with different frameworks and connection modes of Zn2+. While Rb2Zn3(SeO3)4 and Cs2Zn3(SeO3)4·H2O revealed three-dimensional frameworks consisting of isolated ZnO4 tetrahedra and SeO3 polyhedra, Na2Zn3(SeO3)4, Cs2Zn3(SeO3)4, and Cs2Zn2(SeO3)3·2H2O contained two-dimensional [Zn3(SeO3)4]2- layers. Specifically, whereas isolated ZnO4 tetrahedra and SeO3 polyhedra are arranged into two-dimensional [Zn3(SeO3)4]2- layers in two cesium compounds, circular [Zn3O10]14- chains and SeO3 linkers are formed in two-dimensional [Zn3(SeO3)4]2- layers in Na2Zn3(SeO3)4. Close structural examinations suggest that the size of alkali metal is significant in determining the framework geometry as well as connection modes of transition metal cations.

Spin-Orbital Excitations in Ca2RuO4 Revealed by Resonant Inelastic X-Ray Scattering

DEFF Research Database (Denmark)

Das, L.; Forte, F.; Fittipaldi, R.

2018-01-01

The strongly correlated insulator Ca2RuO4 is considered as a paradigmatic realization of both spin-orbital physics and a band-Mott insulating phase, characterized by orbitally selective coexistence of a band and a Mott gap. We present a high resolution oxygen K-edge resonant inelastic x-ray scatt......-Mott scenario. The high-energy excitations correspond to intra-atomic singlet-triplet transitions at an energy scale set by Hund's coupling. Our findings give a unifying picture of the spin and orbital excitations in the band-Mott insulator Ca2RuO4.......The strongly correlated insulator Ca2RuO4 is considered as a paradigmatic realization of both spin-orbital physics and a band-Mott insulating phase, characterized by orbitally selective coexistence of a band and a Mott gap. We present a high resolution oxygen K-edge resonant inelastic x......-ray scattering study of the antiferromagnetic Mott insulating state of Ca2RuO4. A set of low-energy (about 80 and 400 meV) and high-energy (about 1.3 and 2.2 eV) excitations are reported, which show strong incident light polarization dependence. Our results strongly support a spin-orbit coupled band...

(15)N NMR spectroscopy unambiguously establishes the coordination mode of the diimine linker 2-(2'-pyridyl)pyrimidine-4-carboxylic acid (cppH) in Ru(ii) complexes.

Science.gov (United States)

Battistin, Federica; Balducci, Gabriele; Demitri, Nicola; Iengo, Elisabetta; Milani, Barbara; Alessio, Enzo

2015-09-21

We investigated the reactivity of three Ru(ii) precursors -trans,cis,cis-[RuCl2(CO)2(dmso-O)2], cis,fac-[RuCl2(dmso-O)(dmso-S)3], and trans-[RuCl2(dmso-S)4] - towards the diimine linker 2-(2'-pyridyl)pyrimidine-4-carboxylic acid (cppH) or its parent compound 4-methyl-2-(2'-pyridyl)pyrimidine ligand (mpp), in which a methyl group replaces the carboxylic group on the pyrimidine ring. In principle, both cppH and mpp can originate linkage isomers, depending on how the pyrimidine ring binds to ruthenium through the nitrogen atom ortho (N(o)) or para (N(p)) to the group in position 4. The principal aim of this work was to establish a spectroscopic fingerprint for distinguishing the coordination mode of cppH/mpp also in the absence of an X-ray structural characterization. By virtue of the new complexes described here, together with the others previously reported by us, we successfully recorded {(1)H,(15)N}-HMBC NMR spectra at natural abundance of the (15)N isotope on a consistent number of fully characterized Ru(ii)-cppH/mpp compounds, most of them being stereoisomers and/or linkage isomers. Thus, we found that (15)N NMR chemical shifts unambiguously establish the binding mode of cppH and mpp - either through N(o) or N(p)- and can be conveniently applied also in the absence of the X-ray structure. In fact, coordination of cppH to Ru(ii) induces a marked upfield shift for the resonance of the N atoms directly bound to the metal, with coordination induced shifts (CIS) ranging from ca.-45 to -75 ppm, depending on the complex, whereas the unbound N atom resonates at a frequency similar to that of the free ligand. Similar results were found for the complexes of mpp. This work confirmed our previous finding that cppH has no binding preference, whereas mpp binds exclusively through N(p). Interestingly, the two cppH linkage isomers trans,cis-[RuCl2(CO)2(cppH-κN(p))] (5) and trans,cis-[RuCl2(CO)2(cppH-κN(o))] (6) were easily obtained in pure form by exploiting their different

Structural, optical and electronic properties of K2Ba(NO3)4 crystal

Science.gov (United States)

Isaenko, L. I.; Korzhneva, K. E.; Goryainov, S. V.; Goloshumova, A. A.; Sheludyakova, L. A.; Bekenev, V. L.; Khyzhun, O. Y.

2018-02-01

Nitrate crystals reveal nonlinear optical properties and could be considered as converters of laser radiation in the short-wave region. The conditions for obtaining and basic properties of K2Ba(NO3)4 double nitrate crystals were investigated. Crystal growth was implemented by slow cooling in the temperature range of 72-49 °C and low rate evaporation. The structural analysis of K2Ba(NO3)4 formation on the basis of two mixed simple nitrate structures is discussed. The main groups of oscillations in K2Ba(NO3)4 crystal were revealed using Raman and IR spectroscopy, and the table of vibrations for this compound was compiled. The electronic structure of K2Ba(NO3)4 was elucidated in the present work from both experimental and theoretical viewpoints. In particular, X-ray photoelectron spectroscopy (XPS) was employed in the present work to measure binding energies of the atoms constituting the titled compound and its XPS valence-band spectrum for both pristine and Ar+ ion-bombarded surfaces. Further, total and partial densities of states of constituent atoms of K2Ba(NO3)4 have been calculated. The calculations reveal that the O 2p states dominate in the total valence-band region of K2Ba(NO3)4 except of its bottom, where K 3p and Ba 5p states are the principal contributors, while the bottom of the conduction band is composed mainly of the unoccupied O 2p states, with somewhat smaller contributions of the N 2p∗ states as well. With respect to the occupation of the valence band by the O 2p states, the present band-structure calculations are confirmed by comparison on a common energy scale of the XPS valence-band spectrum and the X-ray emission O Kα band for the K2Ba(NO3)4 crystal under study. Furthermore, the present calculations indicate that the K2Ba(NO3)4 compound is a direct-gap material.

Synthesis and crystal structure of Na6[(UO2)3O(OH)3(SeO4)2]2·10H2O

International Nuclear Information System (INIS)

Baeva, E.Eh.; Serezhkina, L.B.; Virovets, A.V.; Peresypkina, E.V.

2006-01-01

The complex Na 6 [(UO 2 ) 3 O(OH) 3 (SeO 4 ) 2 ] 2 ·10H 2 O (I) is synthesized and studied by monocrystal X-ray diffraction. The compound crystallizes in the orthorhombic crystal system with the unit cell parameters: a=14.2225(7) A, b=18.3601(7) A, c=16.5406(6) A, V=4319.2(3) A 3, Z=4, space group Cmcm, R 1 =0.0406. Compound I is found to be a representative of the crystal-chemical group A 3 M 3 M 3 2 T 2 3 (A=UO 2 2+ , M 3 =O 2- , M 2 =OH - , T 3 =SeO 4 2- ) of the uranyl complexes; it contains layer uranium-containing groups [(UO 2 ) 3 O(OH) 3 (SeO 4 ) 2 ] 3- . These layers are linked to form a three-dimensional cage through bonds formed by the sodium atoms with the oxygen atoms of the uranyl ions and SeO 4 groups that belong to different layers [ru

Ti atoms in Ru0.3Ti0.7O2 mixed oxides form active and selective sites for electrochemical chlorine evolution

DEFF Research Database (Denmark)

Karlsson, Rasmus K. B.; Hansen, Heine Anton; Bligaard, Thomas

2014-01-01

affected by the presence of small amounts of Ru dopant, whereas oxygen adsorption is relatively unaffected by Ti dopants in RuO2. The calculations also indicate that coordinatively unsaturated Ti sites on Ru-doped TiO2 and on Ru0.3Ti0.7O2 could form active and selective sites for Cl2 evolution....... These results suggest a reason for why DSA shows a higher chlorine selectivity than RuO2 and propose an experimental test of the hypothesis....

A combined approach for high-performance Li–O2 batteries: A binder-free carbon electrode and atomic layer deposition of RuO2 as an inhibitor–promoter

Directory of Open Access Journals (Sweden)

Hyun-Seop Shin

2018-04-01

Full Text Available A rechargeable lithium–oxygen (Li–O2 battery is considered as a promising technology for electrochemical energy storage systems because its theoretical energy density is much higher than those of state-of-the-art Li-ion batteries. The cathode (positive electrode for Li–O2 batteries is made of carbon and polymeric binders; however, these constituents undergo parasitic decomposition reactions during battery operation, which in turn causes considerable performance degradation. Therefore, the rational design of the cathode is necessary for building robust and high-performance Li–O2 batteries. Here, a binder-free carbon nanotube (CNT electrode surface-modified by atomic layer deposition (ALD of dual acting RuO2 as an inhibitor–promoter is proposed for rechargeable Li–O2 batteries. RuO2 nanoparticles formed directly on the binder-free CNT electrode by ALD play a dual role to inhibit carbon decomposition and to promote Li2O2 decomposition. The binder-free RuO2/CNT cathode with the unique architecture shows outstanding electrochemical performance as characterized by small voltage gaps (∼0.9 V as well as excellent cyclability without any signs of capacity decay over 80 cycles.

A combined approach for high-performance Li-O2 batteries: A binder-free carbon electrode and atomic layer deposition of RuO2 as an inhibitor-promoter

Science.gov (United States)

Shin, Hyun-Seop; Seo, Gi Won; Kwon, Kyoungwoo; Jung, Kyu-Nam; Lee, Sang Ick; Choi, Eunsoo; Kim, Hansung; Hwang, Jin-Ha; Lee, Jong-Won

2018-04-01

A rechargeable lithium-oxygen (Li-O2) battery is considered as a promising technology for electrochemical energy storage systems because its theoretical energy density is much higher than those of state-of-the-art Li-ion batteries. The cathode (positive electrode) for Li-O2 batteries is made of carbon and polymeric binders; however, these constituents undergo parasitic decomposition reactions during battery operation, which in turn causes considerable performance degradation. Therefore, the rational design of the cathode is necessary for building robust and high-performance Li-O2 batteries. Here, a binder-free carbon nanotube (CNT) electrode surface-modified by atomic layer deposition (ALD) of dual acting RuO2 as an inhibitor-promoter is proposed for rechargeable Li-O2 batteries. RuO2 nanoparticles formed directly on the binder-free CNT electrode by ALD play a dual role to inhibit carbon decomposition and to promote Li2O2 decomposition. The binder-free RuO2/CNT cathode with the unique architecture shows outstanding electrochemical performance as characterized by small voltage gaps (˜0.9 V) as well as excellent cyclability without any signs of capacity decay over 80 cycles.

Phase relations in the M2MoO4 - Ag2MoO4 - Hf(MoO4)2 (M=Li, Na) systems

International Nuclear Information System (INIS)

Bazarova, Zh.G.; Bazarov, B.G.; Balsanova, L.V.

2002-01-01

The M 2 MoO 4 - Ag 2 MoO 4 - Hf(MoO 4 ) 2 (M=Li, Na) systems were studied by X-ray diffraction and differential thermal analyses in the subsolidus area (450 - 500 Deg C) for the first time. The formation of the binary compound with the variable composition Li 4-x Hf 1+0.2x (MoO 4 ) 4 (0 ≤ x ≤ 0.6) in the Li 2 MoO 4 - Hf(MoO 4 ) 2 system and the ternary molybdates Li 4 Ag 2 Hf(MoO 4 ) 5 (S 1 ) and Na 2 Ag 2 Hf(MoO 4 ) 4 (S 2 ) was established and the thermal characteristics of the prepared compounds were examined. The new binary molybdate Ag 2 Hf(MoO 4 ) 3 was prepared by the reaction between Ag 2 MoO 4 and Hf(MoO 4 ) 2 [ru

N2,N2,N5,N5-Tetrakis(2-chloroethyl-3,4-dimethylthiophene-2,5-dicarboxamide

Directory of Open Access Journals (Sweden)

Yi-Dan Tang

2010-01-01

Full Text Available In the title compound, C16H22Cl4N2O2S, the two imide groups adopt a trans arrangement relative to the central thienyl ring, so the four terminal 2-chloroethyl arms adopt different orientations. In the crystal, molecules are linked by weak C—H...Cl and C—H...O hydrogen bonds into a three-dimensional network.

RuO4-mediated oxidation of secondary amines 2. imines as main reaction intermediates

Directory of Open Access Journals (Sweden)

Florea Cristina A.

2017-01-01

Full Text Available Oxidation by RuO4 (generated in situ from RuO2 and NaIO4 of secondary amines such as Bn–NH–CH2R (1; R=H, Me gave complex reaction mixtures, but mainly amides. In the presence of cyanide, the leading products were α-aminonitriles. Comparison of the oxidation products of 1 with those from the corresponding imines PhCH=N–CH2R and Bn–N=CH–R showed that formation of the indicated imines is the first main step in the oxidation of 1. A detailed mechanism is proposed.

Multifold Seebeck increase in RuO2 films by quantum-guided lanthanide dilute alloying

International Nuclear Information System (INIS)

Music, Denis; Basse, Felix H.-U.; Schneider, Jochen M.; Han, Liang; Borca-Tasciuc, Theo; Devender; Gengler, Jamie J.; Voevodin, Andrey A.; Ramanath, Ganpati

2014-01-01

Ab initio predictions indicating that alloying RuO 2 with La, Eu, or Lu can increase the Seebeck coefficient α manifold due to quantum confinement effects are validated in sputter-deposited La-alloyed RuO 2 films showing fourfold α increase. Combinatorial screening reveals that α enhancement correlates with La-induced lattice distortion, which also decreases the thermal conductivity twentyfold, conducive for high thermoelectric figures of merit. These insights should facilitate the rational design of high efficiency oxide-based thermoelectrics through quantum-guided alloying

Water adsorption on O(2x2)/Ru(0001) from STM experiments andfirst-principles calculations

Energy Technology Data Exchange (ETDEWEB)

Cabrera-Sanfelix, P.; Sanchez-Portal, D.; Mugarza, A.; Shimizu,T.K.; Salmeron, M.; Arnau, A.

2007-10-15

We present a combined theoretical and experimental study of water adsorption on Ru(0001) pre-covered with 0.25 monolayers (ML) of oxygen forming a (2 x 2) structure. Several structures were analyzed by means of Density Functional Theory calculations for which STM simulations were performed and compared with experimental data. Up to 0.25 monolayers the molecules bind to the exposed Ru atoms of the 2 x 2 unit cell via the lone pair orbitals. The molecular plane is almost parallel to the surface with its H atoms pointing towards the chemisorbed O atoms of the 2 x 2 unit cell forming hydrogen bonds. The existence of these additional hydrogen bonds increases the adsorption energy of the water molecule to approximately 616 meV, which is {approx}220 meV more stable than on the clean Ru(0001) surface with a similar configuration. The binding energy shows only a weak dependence on water coverage, with a shallow minimum for a row structure at 0.125 ML. This is consistent with the STM experiments that show a tendency of the molecules to form linear rows at intermediate coverage. Our calculations also suggest the possible formation of water dimers near 0.25 ML.

The role of CO* as a spectator in CO₂ electro-reduction on RuO₂

DEFF Research Database (Denmark)

Bhowmik, Arghya; Hansen, Heine Anton; Vegge, Tejs

2017-01-01

evolution reaction (HER). We show that a moderate CO* coverage (∼50%) is necessary for obtaining methanol as a product and that higher CO* coverages leads to very low overpotential for formic acid evolution. Our analysis also clarifies the importance of the reaction condition for CO2 reduction to liquid......RuO2-based electrocatalysts are found to be active at low overpotential toward direct electrochemical reduction of CO2 to formic acid and methanol. RuO2 can circumvent the thermodynamic bottleneck resulting from the scaling relations observed on metallic electrocatalyst, by utilizing an alternate...

Magnetic properties of Heusler alloy Mn2RuGe and Mn2RuGa ribbons

International Nuclear Information System (INIS)

Yang, Ling; Liu, Bohua; Meng, Fanbin; Liu, Heyan; Luo, Hongzhi; Liu, Enke; Wang, Wenhong; Wu, Guangheng

2015-01-01

Heusler alloys Mn 2 RuGe and Mn 2 RuGa have been prepared by melt-spinning method successfully. Theoretical and experimental studies reveal a ferrimagnetic ground state in the two alloys. The Curie temperatures are 303 K for Mn 2 RuGe and 272 K for Mn 2 RuGa. The calculated total spin moments of Mn 2 RuGe and Mn 2 RuGa are integral values of 2.00 μ B and 1.03 μ B , respectively. And the theoretical spin polarization ratio is also quite high. However, due to the atomic disorder in the ribbons, the saturation moments of them measured at 5 K are smaller than the calculated values, especially that of Mn 2 RuGa. This coincides with the disappearance of the superlattice reflection (111) and (200) peaks in the XRD pattern of Mn 2 RuGa. Annealing Mn 2 RuGa ribbon at 773 K can enhance the atomic ordering. Both saturation magnetic moment and Curie temperature increase obviously after the heat treatment. - Highlights: • Mn 2 RuGe and Mn 2 RuGa have been prepared by melt-spinning successfully. • Ferrimagnetic ground state has been confirmed in Mn 2 RuGe and Mn 2 RuGa. • High spin polarization has been predicted in Mn 2 RuGe. • Melt-spinning can be a possible way to adjust the atomic order of Heusler alloys

Absence of magnetic long range order in Ba3ZnRu2O9. A spin-liquid candidate in the S = 3/2 dimer lattice

International Nuclear Information System (INIS)

Terasaki, Ichiro; Igarashi, Taichi; Nagai, Takayuki

2017-01-01

We have discovered a novel candidate for a spin liquid state in a ruthenium oxide composed of dimers of S = 3/2 spins of Ru 5+ , Ba 3 ZnRu 2 O 9 . This compound lacks a long range order down to 37 mK, which is a temperature 5000-times lower than the magnetic interaction scale of around 200 K. Partial substitution for Zn can continuously vary the magnetic ground state from an antiferromagnetic order to a spin-gapped state through the liquid state. This indicates that the spin-liquid state emerges from a delicate balance of inter- and intra-dimer interactions, and the spin state of the dimer plays a vital role. This unique feature should realize a new type of quantum magnetism. (author)

Functional properties of electrospun NiO/RuO2 composite carbon nanofibers

International Nuclear Information System (INIS)

Wu Yongzhi; Balakrishna, Rajiv; Reddy, M.V.; Nair, A. Sreekumaran; Chowdari, B.V.R.; Ramakrishna, S.

2012-01-01

Highlights: ► Fabrication of carbon nanofibers with nickel–ruthenium composites by electrospinning. ► An interesting observation of increase in capacitance with increase in the number of cycles for supercapacitor applications. ► Li ion battery testing showed a stable capacity ranging from 350 mAh g −1 to 400 mAh g −1 . ► Lower impedance with the incorporation of 15 wt% Ru precursor than those without Ru. - Abstract: One-dimensional (1D) nickel oxide/ruthenium oxide (NiO/RuO 2 )–carbon composite nanofibers (NiRu–C–NFs) were fabricated via electrospinning of a homogenous mixture of polyacrylonitrile (PAN) and Ni/Ru salt precursors at different ratios followed by heat treatments. The 1D nanostructures of the composite material were characterized by field-emission scanning electron microscopy (FE-SEM), powder X-ray diffraction (XRD), Rietveld refinement and Brunauer–Emmett–Teller (BET) surface area measurements. Li-cycling properties were evaluated using cyclic voltammetry and galvanostatic properties. The asymmetric hybrid supercapacitor studies were carried out with activated carbon as a cathode and NiRu–C–NFs composites as anodes in the cycling range, 0.005–3.0 V using 1 M LiPF 6 (EC;DMC) electrolyte. NiRu–C–NFs fabricated from 5 wt% nickel (II) and 15 wt% ruthenium (III) precursors showed a capacitance up to ∼60 F g −1 after 30 cycles. Anodic Li-cycling studies of NiRu–C–NF-0 and NiRu–C–NF-2 composite samples showed a reversible capacity of 230 and 350 m Ahg −1 at current rate of 72 mA g −1 at the end of 40th cycle in the voltage range of 0.005–3.0 V. Electrochemical impedance studies (EIS) on NiRu–C–NFs showed lower impedance value for 15 wt% Ru than the bare sample.

Hall effect and magnetization in the magnetic superconductor RuSr2GdCu2O8

International Nuclear Information System (INIS)

Jurelo, A.R.; Pimentel, J.L.; Wolff Fabris, F.; Schaf, J.; Pureur, P.; Vieira, V.N.

2006-01-01

We report on Hall effect, longitudinal resistivity and magnetization measurements in the rutheno-cuprate RuSr 2 GdCu 2 O 8 . Combining these results we separate the anomalous contribution to the Hall effect and argue that the occurrence of canting and chirality have to be considered for describing this property

Ferromagnetic interactions in Ru(III)-nitronyl nitroxide radical complex: a potential 2p4d building block for molecular magnets.

Science.gov (United States)

Pointillart, Fabrice; Bernot, Kevin; Sorace, Lorenzo; Sessoli, Roberta; Gatteschi, Dante

2007-07-07

The reaction between [Ru(salen)(PPh3)Cl] and the 4-pyridyl-substituted nitronyl nitroxide radical (NITpPy) leads to the [Ru(salen)(PPh3)(NITpPy)](ClO4)(H2O)2 complex while the reaction with the azido anion (N3-) leads to the [Ru(salen)(PPh3)(N3)] complex 2 (where salen2- = N,N'-ethan-1,2-diylbis(salicylidenamine) and PPh3 = triphenylphosphine). Both compounds have been characterized by single crystal X-ray diffraction. The two crystal structures are composed by a [Ru(III)(salen)(PPh3)]+ unit where the Ru(III) ion is coordinated to a salen2- ligand and one PPh3 ligand in axial position. In 1 the Ru(III) ion is coordinated to the 4-pyridyl-substituted nitronyl nitroxide radical whereas in 2 the second axial position is occupied by the azido ligand. In both complexes the Ru(III) ions are in the same environment RuO2N3P, in a tetragonally elongated octhaedral geometry. The crystal packing of 1 reveals pi-stacking in pairs. While antiferromagnetic intermolecular interaction (J2 = 5.0 cm(-1)) dominates at low temperatures, ferromagnetic intramolecular interaction (J1 = -9.0 cm(-1)) have been found between the Ru(III) ion and the coordinated NITpPy.

Mechanical properties of polycrystalline RuSr2GdCu2O8 superconductor

International Nuclear Information System (INIS)

Brum Leite Gusmao Pinheiro, Lincoln; Serbena, Francisco Carlos; Foerster, Carlos Eugenio; Rodrigues, Pedro Junior; Jurelo, Alcione Roberto; Chinelatto, Adilson Luiz; Junior, Jorge Luiz Pimentel

2011-01-01

Research highlights: → Hardness and elastic modulus of Ru-1212 phase measured by instrumented indentation are reported. → Polycrystalline samples were produced by a solid state reaction technique. → Samples were also characterized by SEM, XRD and electrical resistivity measurements. → Hardness and elastic modulus were 8.6 GPa and 145 GPa, respectively. → These values are comparable with those of Y-123. - Abstract: The main objective of this paper is to report the room temperature hardness and elastic modulus of the RuSr 2 GdCu 2 O 8 superconductor phase by instrumented indentation. Polycrystalline samples were produced by a solid state reaction technique. The samples were also characterized by scanning electron microscopy, X-ray diffraction and electrical resistivity measurements. The influence of porosity on the mechanical properties was avoided by considering only those indentations inside the grains. The hardness and elastic modulus were 8.6 GPa and 145 GPa, respectively. These values are comparable with those of Y-123. The indentation fracture toughness evaluated after conventional Vickers indentation was 1.9 MPa m 1/2 .

2-((1E-1-{2-[(2Z-3,4-Diphenyl-2,3-dihydro-1,3-thiazol-2-ylidene]hydrazin-1-ylidene}ethylpyridin-1-ium bromide monohydrate

Directory of Open Access Journals (Sweden)

Mehmet Akkurt

2014-04-01

Full Text Available In the title compound, C22H19N4S+·Br−·H2O, the dihedral angles between the phenyl groups and the mean plane of the thiazolylidene ring are 34.69 (13 and 64.27 (13°, respectively, while that between the thiazolylidene and pyridinium rings is 14.73 (13°. In the crystal, zigzag chains of alternating bromide ions and water molecules associate through O—H...Br interactions run in channels approximately parallel to the b axis. These chains help form parallel chains of cations through N—H...O, C—H...N and C—H...Br hydrogen bonds.

B11 NMR in the layered diborides OsB2 and RuB2

Science.gov (United States)

Suh, B. J.; Zong, X.; Singh, Y.; Niazi, A.; Johnston, D. C.

2007-10-01

B11 nuclear magnetic resonance (NMR) measurements have been performed on B11 enriched OsB2 and RuB2 polycrystalline powder samples in an external field of 4.7T and in the temperature range, 4.2KOsB2 and RuB2 , respectively. The experimental results indicate that a p character dominates the conduction electron wave function at the B site with a negligibly small s character in both compounds.

Structural phase transitions at high-temperature in double perovskite Sr{sub 2}GdRuO{sub 6}

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

2012-08-15

The crystal structure evolution 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. Powder X-ray diffraction measurements at room temperature and Rietveld analysis show that this compounds crystallizes in a monoclinic perovskite-type structure with P2{sub 1}/n (no. 14) space group and the 1:1 ordered arrangement of Ru{sup 5+} and Gd{sup 3+} cations over the six-coordinate M sites, with lattice parameters a=5.81032(8) A, b=5.82341(4) A, c=8.21939(7) A, V=278.11(6) A{sup 3} and angle {beta}=90.311(2){sup o}. The high-temperature analysis shows that this material suffers two-phase transitions. At 373 K it adopts a monoclinic perovskite structure with I2/m space group, and lattice parameters a=5.81383(2) A, b=5.82526(4) A, c=8.22486(1) A, V=278.56(2) A{sup 3} and angle {beta}=90.28(2){sup o}. Above of 773 K, it suffers a phase transition from monoclinic I2/m to tetragonal I4/m, with lattice parameters a=5.84779(1) A, c=8.27261(1) A, V=282.89(5) A{sup 3} and angle {beta}=90.02(9){sup o}. The high-temperature phase transition from monoclinic I2/m to tetragonal I4/m is characterized by strongly anisotropic displacements of the anions.

The influence of alizarin and fluorescein on the photoactivity of Ni, Pt and Ru-doped TiO2 layers

International Nuclear Information System (INIS)

Rosu, Marcela-Corina; Suciu, Ramona-Crina; Lazar, Mihaela D.; Bratu, I.

2013-01-01

Highlights: ► The Ni, Pt, Ru-doped TiO 2 materials and sensitized with alizarin and fluorescein dyes were prepared by wet chemical route. ► The samples were characterized by: UV–vis spectroscopy, spectrofluorimetry, FT/IR spectroscopy and microscopy, X-ray diffraction and N 2 physisorption measurements. ► A combined influence of the dopants and dyes was observed, leading to a beneficial effect to TiO 2 photoactivity. -- Abstract: The doping with different metal ions and sensitization with organic compounds are two well known methods used to improve the photoactivity of TiO 2 . In this respect, the metallic ions-doped TiO 2 samples were prepared by embedding Ni, Pt and Ru ions into TiO 2 crystalline network and then, each sample was sensitized with alizarin and fluorescein dyes. The qualitative evaluation of prepared TiO 2 -based materials was made by: UV–vis spectroscopy, spectrofluorimetry, FT/IR spectroscopy and microscopy, X-ray diffraction and N 2 physisorption measurements. The optoelectronic properties investigated by UV–vis spectroscopy show that the optical response of Ni-doped TiO 2 layer shifts to visible. The X-ray spectra do not show peaks of nickel, platinum and ruthenium oxide crystals or pure metals. The FT/IR spectra proved the presence of dye molecules adsorbed on titania nanoparticles surface. These results demonstrated that the studied dopants and dyes have potential to promote modified TiO 2 -based materials as good candidates to be used in photolectrocatalytic processes

Physical properties and characterization of RuSr2GdCu2O8 (Ru-1212) grown by top seeded melt textured technique

International Nuclear Information System (INIS)

Uthayakumar, S.; Santhosh, P.; Gombos, M.; Babu, M. Ramesh; Jayavel, R.; Vecchione, A.; Pace, S.

2009-01-01

Efforts have been made in optimizing growth conditions for bulk textured growth of RuSr 2 GdCu 2 O 8 (Ru-1212) employing top seeded growth technique (TSG). Thermal stability and peritectic temperature (T p ) have been determined by TG-DTA analysis. The study facilitates appropriate thermal treatments to yield good quality sample. The structural study of the as grown sample has been carried out by X-ray diffraction technique. Morphological study by polarized optical microscope (PLOM) and scanning electron microscope (SEM) reveals the growth mechanism. Subsequently, the stoichiometry has been confirmed by energy dispersive X-ray analysis (EDAX). The observed characterization results show the influence of superconducting property on growth technique and allow one to correlate between the physical properties and experimental technique.

Chern structure in the Bose-insulating phase of Sr2RuO4 nanofilms

Science.gov (United States)

Nobukane, Hiroyoshi; Matsuyama, Toyoki; Tanda, Satoshi

2017-01-01

The quantum anomaly that breaks the symmetry, for example the parity and the chirality, in the quantization leads to a physical quantity with a topological Chern invariant. We report the observation of a Chern structure in the Bose-insulating phase of Sr2RuO4 nanofilms by employing electric transport. We observed the superconductor-to-insulator transition by reducing the thickness of Sr2RuO4 single crystals. The appearance of a gap structure in the insulating phase implies local superconductivity. Fractional quantized conductance was observed without an external magnetic field. We found an anomalous induced voltage with temperature and thickness dependence, and the induced voltage exhibited switching behavior when we applied a magnetic field. We suggest that there was fractional magnetic-field-induced electric polarization in the interlayer. These anomalous results are related to topological invariance. The fractional axion angle Θ = π/6 was determined by observing the topological magneto-electric effect in the Bose-insulating phase of Sr2RuO4 nanofilms.

Initial Reduction of CO2 on Pd-, Ru-, and Cu-Doped CeO2(111) Surfaces: Effects of Surface Modification on Catalytic Activity and Selectivity.

Science.gov (United States)

Guo, Chen; Wei, Shuxian; Zhou, Sainan; Zhang, Tian; Wang, Zhaojie; Ng, Siu-Pang; Lu, Xiaoqing; Wu, Chi-Man Lawrence; Guo, Wenyue

2017-08-09

Surface modification by metal doping is an effective treatment technique for improving surface properties for CO 2 reduction. Herein, the effects of doped Pd, Ru, and Cu on the adsorption, activation, and reduction selectivity of CO 2 on CeO 2 (111) were investigated by periodic density functional theory. The doped metals distorted the configuration of a perfect CeO 2 (111) by weakening the adjacent Ce-O bond strength, and Pd doping was beneficial for generating a highly active O vacancy. The analyses of adsorption energy, charge density difference, and density of states confirmed that the doped metals were conducive for enhancing CO 2 adsorption, especially for Cu/CeO 2 (111). The initial reductive dissociation CO 2 → CO* + O* on metal-doped CeO 2 (111) followed the sequence of Cu- > perfect > Pd- > Ru-doped CeO 2 (111); the reductive hydrogenation CO 2 + H → COOH* followed the sequence of Cu- > perfect > Ru- > Pd-doped CeO 2 (111), in which the most competitive route on Cu/CeO 2 (111) was exothermic by 0.52 eV with an energy barrier of 0.16 eV; the reductive hydrogenation CO 2 + H → HCOO* followed the sequence of Ru- > perfect > Pd-doped CeO 2 (111). Energy barrier decomposition analyses were performed to identify the governing factors of bond activation and scission along the initial CO 2 reduction routes. Results of this study provided deep insights into the effect of surface modification on the initial reduction mechanisms of CO 2 on metal-doped CeO 2 (111) surfaces.

A dielectric barrier discharge (DBD) plasma reactor: an efficient tool to prepare novel RuO2 nanorods

International Nuclear Information System (INIS)

Ananth, Antony; Gandhi, Mani Sanjeeva; Mok, Young Sun

2013-01-01

One-dimensional (1D) nanostructured materials have attracted a great deal of interest owing to their potential applications in various industries. Due to the limitations and cost associated with conventional low-pressure plasma systems, atmospheric-pressure plasma techniques such as dielectric barrier discharges (DBDs) are investigated as an alternative approach for inducing specific chemical reactions. RuO 2 nanomaterials are widely used as supercapacitor electrodes, in field-emission devices and for catalytic applications. In such applications, size and shape dependent properties of nanomaterials play critical roles in improving the performance. In this paper, an attempt is made to prepare 1D RuO 2 nanostructured materials using a DBD plasma. It is reported here that the composition of feed gas is an important factor in determining the final morphology. For example, an Ar + H 2 plasma yields aggregated RuO 2 nanostructures, whereas ‘nanopillar’ and ‘nanorod’ morphologies are obtained when using Ar + O 2 and Ar, respectively. Possible mechanisms behind the morphological differences are elucidated on the basis of the temperature variations inside the plasma reactor and the chemistry of the gaseous reactive species. The application of a DBD plasma to the synthesis of RuO 2 nanorods is reported for the first time in this paper. (paper)

Electrochemical capacitance of nanostructured ruthenium-doped tin oxide Sn1- x Ru x O2 by the microemulsion method

Science.gov (United States)

Saraswathy, Ramanathan

2017-12-01

Synthesis of nanostructured Ru-doped SnO2 was successfully carried out using the reverse microemulsion method. The phase purity and the crystallite size were analyzed by XRD. The surface morphology and the microstructure of synthesized nanoparticles were analyzed by SEM and TEM. The vibration mode of nanoparticles was investigated using FTIR and Raman studies. The electrochemical behavior of the Ru-doped SnO2 electrode was evaluated in a 0.1 mol/L Na2SO4 solution using cyclic voltammetry. The 5% Ru-doped SnO2 electrode exhibited a high specific capacitance of 535.6 F/g at a scan rate 20 mV/s, possessing good conductivity as well as the electrocycling stability. The Ru-doped SnO2 composite shows excellent electrochemical properties, suggesting that this composite is a promising material for supercapacitors.

Ruthenium(II) carbonyl compounds with the 4'-chloro-2,2':6',2''-terpyridine ligand.

Science.gov (United States)

Tatikonda, Rajendhraprasad; Haukka, Matti

2017-04-01

Two ruthenium carbonyl complexes with the 4'-chloro-2,2':6',2''-terpyridine ligand (tpy-Cl, C 15 H 10 ClN 3 ), i.e. [RuCl(tpy-Cl)(CO) 2 ][RuCl 3 (CO) 3 ] (I) [systematic name: cis -di-carbonyl-chlorido(4'-chloro-2,2':6',2''-terpyridine-κ 3 N )ruthenium(II) fac -tricarbonyltri-chlorido-ruthenate(II)], and [RuCl 2 (tpy-Cl)(CO) 2 ] (II) [ cis -dicarbonyl- trans -di-chlorido(4'-chloro-2,2':6',2''-terpyridine-κ 2 N 1 , N 1' )ruthenium(II)], were synthesized and characterized by single-crystal X-ray diffraction. The Ru II atoms in both centrosymmetric structures (I) and (II) display similar, slightly distorted octa-hedral coordination spheres. The coordination sphere in the complex cation in compound (I) is defined by three N atoms of the tridentate tpy-Cl ligand, two carbonyl carbon atoms and one chlorido ligand; the charge is balanced by an octa-hedral [Ru(CO) 3 Cl 3 ] - counter-anion. In the neutral compound (II), the tpy-Cl ligand coordinates to the metal only through two of its N atoms. The coordination sphere of the Ru II atom is completed by two carbonyl and two chlorido ligands. In the crystal structures of both (I) and (II), weak C-H⋯Cl inter-actions are observed.

Synthesis and crystal structure of a new neodymium(III) selenate-selenite: Nd2(SeO4)(SeO3)2(H2O)2

International Nuclear Information System (INIS)

Feng Meiling; Mao Jianggao

2005-01-01

The title new neodymium(III) selenate-selenite was obtained by hydrothermal reactions of neodymium(III) oxide, H 2 SeO 4 and 1,10-phenanthroline at 140 o C. Its structure was established by single-crystal X-ray diffraction. The title compound crystallizes in the monoclinic space group C2/c with cell parameters of a = 12.258(2) A, b 7.1024(15) A, c = 13.391(3) A, β = 104.250(2) o . The structure of Nd 2 (SeO 4 )(SeO 3 ) 2 (H 2 O) 2 is isomorphous with that of Er 2 (SeO 4 )(SeO 3 ) 2 (H 2 O) 2 , which was refined in the monoclinic space group C2 with the disordered selenate group. It features an ordered 3D network with channels along b-axis. The selenate or selenite groups alone can form a 2D layer with the Nd(III) ions. IR spectrum, TGA and luminescent studies have also been performed

Selective Hydrogenation of m-Dinitrobenzene to m-Nitroaniline over Ru-SnOx/Al2O3 Catalyst

Directory of Open Access Journals (Sweden)

Haiyang Cheng

2014-07-01

Full Text Available Series catalysts of Ru-SnOx/Al2O3 with varying SnOx loading of 0–3 wt% were prepared, and their catalytic activity and selectivity have been discussed and compared for the selective hydrogenation of m-dinitrobenzene (m-DNB to m-nitroaniline (m-NAN. The Ru-SnOx/Al2O3 catalysts were characterized by X-ray powder diffraction (XRD, X-ray photoelectron spectroscopy (XPS, transmission electron microscopy (TEM and hydrogen temperature-programmed reduction (H2-TPR and desorption (H2-TPD. Under the modification of SnOx, the reaction activity increased obviously, and the best selectivity to m-NAN reached above 97% at the complete conversion of m-DNB. With the increasing of the SnOx loading, the amount of active hydrogen adsorption on the surface of the catalyst increased according to the H2-TPD analysis, and the electron transferred from Ru to SnOx species, as determined by XPS, inducing an electron-deficient Ru, which is a benefit for the absorption of the nitro group. Therefore, the reaction rate and product selectivity were greatly enhanced. Moreover, the Ru-SnOx/Al2O3 catalyst presented high stability: it could be recycled four times without any loss in activity and selectivity.

Competing magnetic fluctuations in Sr3Ru2O7 probed by Ti doping

DEFF Research Database (Denmark)

Hooper, J.; Fang, M.H.; Zhou, M.

2007-01-01

We report the effect of nonmagnetic Ti4+ impurities on the electronic and magnetic properties of Sr3Ru2O7. Small amounts of Ti suppress the characteristic peak in magnetic susceptibility near 16 K and result in a sharp upturn in specific heat. The metamagnetic quantum phase transition and related...... anomalous features are quickly smeared out by small amounts of Ti. These results provide strong evidence for the existence of competing magnetic fluctuations in the ground state of Sr3Ru2O7. Ti doping suppresses the low-temperature antiferromagnetic interactions that arise from Fermi surface nesting...

Polyelectrolyte-based electrochemiluminescence enhancement for Ru(bpy){sub 3}{sup 2+} loaded by SiO{sub 2} nanoparticle carrier and its high sensitive immunoassay

Energy Technology Data Exchange (ETDEWEB)

Ge, Zhi-Li; Song, Tian-Mei; Chen, Zhe [College of Pharmaceutical Science, Soochow University, Suzhou 215123 (China); Guo, Wu-Run [College of Pharmaceutical Science, Soochow University, Suzhou 215123 (China); College of Chemistry and Chemical Engineering, China West Normal University, Nanchong 637002 (China); Xie, Hong-Ping, E-mail: hpxie@suda.edu.cn [College of Pharmaceutical Science, Soochow University, Suzhou 215123 (China); Xie, Lian, E-mail: xielian@suda.edu.cn [College of Pharmaceutical Science, Soochow University, Suzhou 215123 (China)

2015-03-03

Highlights: • Preparation of strong ECL nanoparticles PAA–Ru@SiO{sub 2}/[PAA⋯Ru&Nafion⋯Ru]. • Ion-pair macromolecule PAA–Ru formed to greatly increase the doping amount. • PAA&Nafion membrane increased the amount of ion-exchanged Ru(bpy){sub 3}{sup 2+}. • PAA&Nafion membrane enhanced the ability of electron transfer. • Realized antibody labeling and established a high-sensitive immunoassay. - Abstract: In this paper the strong electrochemiluminescence (ECL) nanoparticles have been prepared based on the anionic polyelectrolyte sodium polyacrylate (PAA)-ECL enhancement for Ru(bpy){sub 3}{sup 2+}, which were loaded by the carrier of SiO{sub 2} nanoparticle. There were two kinds of Ru(bpy){sub 3}{sup 2+} for the as-prepared nanoparticles, the doped one and the exchanged one. The former was loaded inside the ECL nanoparticles by doping, in a form of ion-pair macromolecules PAA–Ru(bpy){sub 3}{sup 2+}. The corresponding ECL was enhanced about 2 times owing to the doping increase of Ru(bpy){sub 3}{sup 2+}. The latter was loaded on the PAA-doped Nafion membrane by ion exchange. The corresponding ECL was enhanced about 3 times owing to the ion-exchanging increase of Ru(bpy){sub 3}{sup 2+}. At the same time, ECL intensity of the doped-inside Ru(bpy){sub 3}{sup 2+} was further enhanced 13 times because polyelectrolyte PAA in the doped membrane could obviously enhance electron transfer between the doped Ru(bpy){sub 3}{sup 2+} and the working electrode. Furthermore, based on hydrophobic regions of the doped membrane antibody labeling could be easily realized by the as-prepared nanoparticles and then a high sensitive ECL immunoassay for HBsAg was developed. The linear range was between 1.0 and 100 pg mL{sup −1} (R{sup 2} = 0.9912). The detection limit could be as low as 0.11 pg mL{sup −1} (signal-to-noise ratio = 3)

Multifold Seebeck increase in RuO{sub 2} films by quantum-guided lanthanide dilute alloying

Energy Technology Data Exchange (ETDEWEB)

Music, Denis, E-mail: music@mch.rwth-aachen.de; Basse, Felix H.-U.; Schneider, Jochen M. [Materials Chemistry, RWTH Aachen University, Kopernikusstr. 10, D-52074 Aachen (Germany); Han, Liang; Borca-Tasciuc, Theo [Department of Mechanical, Aerospace and Nuclear Engineering, Rensselaer Polytechnic Institute, 110 8th St., Troy, New York 12180 (United States); Devender [Materials Science and Engineering Department, Rensselaer Polytechnic Institute, 110 8th St., Troy, New York 12180 (United States); Gengler, Jamie J. [Air Force Research Laboratory, Materials and Manufacturing Directorate, WPAFB, Ohio 45433 (United States); Spectral Energies, LLC, Dayton, Ohio 45431 (United States); Voevodin, Andrey A. [Air Force Research Laboratory, Materials and Manufacturing Directorate, WPAFB, Ohio 45433 (United States); Ramanath, Ganpati [Materials Chemistry, RWTH Aachen University, Kopernikusstr. 10, D-52074 Aachen (Germany); Materials Science and Engineering Department, Rensselaer Polytechnic Institute, 110 8th St., Troy, New York 12180 (United States)

2014-02-03

Ab initio predictions indicating that alloying RuO{sub 2} with La, Eu, or Lu can increase the Seebeck coefficient α manifold due to quantum confinement effects are validated in sputter-deposited La-alloyed RuO{sub 2} films showing fourfold α increase. Combinatorial screening reveals that α enhancement correlates with La-induced lattice distortion, which also decreases the thermal conductivity twentyfold, conducive for high thermoelectric figures of merit. These insights should facilitate the rational design of high efficiency oxide-based thermoelectrics through quantum-guided alloying.

Hydrothermal synthesis and crystal structure of a new molybdenum oxide compound with manganese-o-phen subunit: [Mn(o-phen)(H2O)MoO4]·H2O (o-phen=o-phenanthroline)

International Nuclear Information System (INIS)

Zhang Quanzheng; Lu Canzhong; Yang Wenbin; Chen Shumei; Yu Yaqin; He Xiang; Yan Ying; Liu Jiuhui; Xu Xinjiang; Xia Changkun; Wu Xiaoyuan; Chen Lijuan

2004-01-01

A new one-dimensional molybdenum oxide compound with manganese-o-phen subunit: [Mn(o-phen)(H 2 O)MoO 4 ]·H 2 O (1) (o-phen=o-phenanthroline) was synthesized by the hydrothermal reaction of Na 2 MoO 4 ·2H 2 O, MnSO 4 ·H 2 O, oxalic acid, o-phenanthroline (o-phen) and water. Its structure was determined by elemental analyses, ESR spectrum, TG analysis, IR spectrum and single-crystal X-ray diffraction. Compound 1 crystallizes in triclinic system, space group P-1 with a=7.0401(2) A, b=10.4498(2) A, c=10.5720(2) A, α=73.26(7) deg., β=83.34(8) deg., γ=77.33(9) deg., V=725.5089(0) A 3 , Z=2, and R 1 =0.0322 for 2337 observed reflections. Compound 1 exhibits one-dimensional chain structure. The chains are linked up via hydrogen bonding to 2D layers, which are further assembled through π-π stacking interactions to a 3D supermolecular structure

A characteristic study of CCF modeling techniques and optimization of CCF defense strategies

International Nuclear Information System (INIS)

Kim, Min Chull

2000-02-01

Common Cause Failures (CCFs ) are among the major contributors to risk and core damage frequency (CDF ) from operating nuclear power plants (NPPs ). Our study on CCF focused on the following aspects : 1) a characteristic study on the CCF modeling techniques and 2) development of the optimal CCF defense strategy. Firstly, the characteristics of CCF modeling techniques were studied through sensitivity study of CCF occurrence probability upon system redundancy. The modeling techniques considered in this study include those most widely used worldwide, i.e., beta factor, MGL, alpha factor, and binomial failure rate models. We found that MGL and alpha factor models are essentially identical in terms of the CCF probability. Secondly, in the study for CCF defense, the various methods identified in the previous studies for defending against CCF were classified into five different categories. Based on these categories, we developed a generic method by which the optimal CCF defense strategy can be selected. The method is not only qualitative but also quantitative in nature: the selection of the optimal strategy among candidates is based on the use of analytic hierarchical process (AHP). We applied this method to two motor-driven valves for containment sump isolation in Ulchin 3 and 4 nuclear power plants. The result indicates that the method for developing an optimal CCF defense strategy is effective

Half-metallic and insulating natures in Ru-based ordered double perovskite oxides Ba{sub 2}X{sup III}Ru{sup V}O{sub 6} (X = V, Cr) induced by 3d-t{sub 2g}{sup n} orbital filling

Energy Technology Data Exchange (ETDEWEB)

Saad, H.-E.M. Musa, E-mail: musa.1964@gmail.com; Althoyaib, S.S.

2017-04-01

In this paper, we present results of a comprehensive systemic study of the crystal, electronic and magnetic structures on two members of Ru-based ordered double perovskite oxides Ba{sub 2}XRuO{sub 6} (X = V, Cr). For the corporate compound, the analysis of density of states (DOS) results suggests that the 3d-t{sub 2g} orbital filling plays a major role in governing the conduction mechanism in these systems. The DOS and magnetic results show that Ba{sub 2}XRuO{sub 6} exhibits half-metallic (HM) nature as X = V, where the electronic structure of Ba{sub 2}V{sup III}Ru{sup V}O{sub 6} with 3d-t{sub 2g}{sup 2} behaves like that of HM ferrimagnetic (FI), switches to compensate FI insulating behavior as X = Cr, with an extra electron filled 3d-t{sub 2g}{sup 3} in Ba{sub 2}Cr{sup III}Ru{sup V}O{sub 6}. We find, on consideration of electron correlation (LSDA+U) and spin-orbital coupling (SOC) effects that the electronic structure of Ba{sub 2}XRuO{sub 6} takes a HM nature, whereas it is completely transformed to insulating nature once an extra electron filled the 3d-t{sub 2g} orbitals in X = Cr case. Such tuning is accompanied by spin-state hopping of one electron from half-filled spin-state in Ru{sup V} (t{sub 2g}{sup 3} e{sub g}{sup 0}) to two and three occupied spin-state in V{sup III} (t{sub 2g}{sup 2} e{sub g}{sup 0}) and Cr{sup III} (t{sub 2g}{sup 3} e{sub g}{sup 0}), respectively. The charge distribution results show that this extra electron occupies chiefly the spin-down of conduction orbitals and plays a major role in determining the electronic and magnetic structures of Ba{sub 2}XRuO{sub 6} system. - Highlights: • Half-metallic and insulating natures are observed in Ba{sub 2}XRuO{sub 6} (X = V, Cr). • 3d-t{sub 2g}{sup n} orbitals filling plays a major role in governing the conduction mechanism. • LSDA+U method under density functional theory (DFT) is considered. • HM ferrimagnetic (FI) (X = V) switch to compensate FI insulating (X = Cr).

Preparation of supported heterogeneous catalysts by pulse impregnation: Application to Ru[sub 3](CO)[sub 12]/2,2[prime]-bipyridine/SiO[sub 2] catalyst

Energy Technology Data Exchange (ETDEWEB)

Haukka, M.; Pakkanen, T.A. (Univ. of Joensuu (Finland))

1994-07-01

In this paper, the authors introduce pulse impregnation, a method for preparing supported heterogeneous catalysts by successive impregnation cycles. Pulse impregnation is a method for preparing supported heterogeneous catalysts from the liquid phase. In the pulse-impregnation technique the catalyst surface is grown gradually in consecutive cycles, with each cycle consisting of separate deposition and activation steps. During the deposition step, the catalyst precursor or precursors are deposited onto the support from a suitable solvent. The actual chemically bonded catalyst phase is formed during the activation step (e.g., thermal activation). Pulse impregnation was tested in the separate deposition of 2,2[prime]-bipyridine and Ru[sub 3](CO)[sub 12] onto a silica support, and in the preparation of Ru[sub 3](CO)[sub 12]/2,2[prime]-bipyridine/SiO[sub 2] catalyst, in a column-type reactor system. Macroscopically uniform deposition was achieved with both 2,2[prime]-bipyridine and Ru[sub 3](CO)[sub 12]. Various solvent systems were used to control the amount of solute adsorbed during deposition. In the preparation of the Ru[sub 3](CO)[sub 12]/2,2[prime]-bipyridine/SiO[sub 2] catalyst, the ruthenium content increased nearly linearly with the number of preparation cycles. The effects of the preparation method on the catalyst activity was also tested in 1-hexane hydroformylation. 31 refs., 7 figs., 1 tab.

Development of Al2O3 carrier-Ru composite catalyst for hydrogen generation from alkaline NaBH4 hydrolysis

International Nuclear Information System (INIS)

Huang, Yao-Hui; Su, Chia-Chi; Wang, Shu-Ling; Lu, Ming-Chun

2012-01-01

A recyclable and reusable Ru/Al 2 O 3 catalyst is prepared for hydrogen generation from the hydrolysis process of alkaline sodium borohydride (NaBH 4 ) solution. The hydrogen generation rate by the hydrolysis and methanolysis of alkaline NaBH 4 was explored as a function of NaOH concentration. Meantime, the byproducts derived from the spent alkaline NaBH 4 solution were characterized by X-ray diffraction (XRD), scanning electro microscope/energy dispersive spectrometer (SEM/EDS) and NMR (Nuclear Magnetic Resonance). The effect of NaOH concentration on the hydrogen generation from the hydrolysis of NaBH 4 significantly depends on the type of catalysts. With increasing NaOH concentration, the hydrogen generation rates decrease when using ruthenium (Ru) composite as a catalyst. The hydrogen generation rate of the methanolysis of NaBH 4 is significantly inhibited in the presence of NaOH as compared with the hydrolysis of NaBH 4 . The durability test of the Ru/Al 2 O 3 catalyst shows that the hydrogen generation rate decreases with recycling and reuse. The XRD and NMR analysis results show that the borate hydrate (NaBO 2 H 2 O) was derived from the hydrolysis of 20 wt% and 30 wt% NaBH 4 . -- Highlights: ► A recyclable Ru/Al 2 O 3 catalyst was synthesized for hydrogen generation. ► Ru/Al 2 O 3 significantly promotes the hydrogen generation rate from alkaline NaBH 4 solution. ► The prepared Ru/Al 2 O 3 catalyst can easily collect from the spent alkaline NaBH 4 solution.

The influence of alizarin and fluorescein on the photoactivity of Ni, Pt and Ru-doped TiO{sub 2} layers

Energy Technology Data Exchange (ETDEWEB)

Rosu, Marcela-Corina, E-mail: marcela.rosu@itim-cj.ro [National Institute for Research and Development of Isotopic and Molecular Technologies, 65-103 Donath Street, 400293, Cluj-Napoca (Romania); Suciu, Ramona-Crina; Lazar, Mihaela D.; Bratu, I. [National Institute for Research and Development of Isotopic and Molecular Technologies, 65-103 Donath Street, 400293, Cluj-Napoca (Romania)

2013-04-20

Highlights: ► The Ni, Pt, Ru-doped TiO{sub 2} materials and sensitized with alizarin and fluorescein dyes were prepared by wet chemical route. ► The samples were characterized by: UV–vis spectroscopy, spectrofluorimetry, FT/IR spectroscopy and microscopy, X-ray diffraction and N{sub 2} physisorption measurements. ► A combined influence of the dopants and dyes was observed, leading to a beneficial effect to TiO{sub 2} photoactivity. -- Abstract: The doping with different metal ions and sensitization with organic compounds are two well known methods used to improve the photoactivity of TiO{sub 2}. In this respect, the metallic ions-doped TiO{sub 2} samples were prepared by embedding Ni, Pt and Ru ions into TiO{sub 2} crystalline network and then, each sample was sensitized with alizarin and fluorescein dyes. The qualitative evaluation of prepared TiO{sub 2}-based materials was made by: UV–vis spectroscopy, spectrofluorimetry, FT/IR spectroscopy and microscopy, X-ray diffraction and N{sub 2} physisorption measurements. The optoelectronic properties investigated by UV–vis spectroscopy show that the optical response of Ni-doped TiO{sub 2} layer shifts to visible. The X-ray spectra do not show peaks of nickel, platinum and ruthenium oxide crystals or pure metals. The FT/IR spectra proved the presence of dye molecules adsorbed on titania nanoparticles surface. These results demonstrated that the studied dopants and dyes have potential to promote modified TiO{sub 2}-based materials as good candidates to be used in photolectrocatalytic processes.

Reactivity toward alcohols of (Ru/sup IV/ = O/sup 2-/) unit in trans-(RuCl(O)(py)/sub 4/)/sup +/

Energy Technology Data Exchange (ETDEWEB)

Aoyagi, Kimitake; Nagao, Hirotaka; Yukawa, Yasuhiko; Ogura, Mariko; Kuwayama, Akito; Howell, F S; Mukaida, Masao; Kakihana, Hidetake

1986-12-01

The reactivity with alcohol of trans-(RuCl(O)(py)/sub 4/)/sup +/ was investigated. In MeOH, trans-(RuCl(OH)(py)/sub 4/)/sup +/ was confirmed to exist as a precursor in the formation of trans-(RuCl(OMe)(py)/sub 4/)/sup +/. The reaction progress was traced by spectrometrical and /sup 18/O-labelling experiments.

Influence of the electronic structures on the heterogeneous photoelectrocatalytic performance of Ti/Ru{sub x}Sn{sub 1-x}O{sub 2} electrodes

Energy Technology Data Exchange (ETDEWEB)

Chen, Zhijie, E-mail: 1061739408@qq.com [College of Materials Science and Engineering, Fuzhou University, Fuzhou, Fujian 350108 (China); Zhu, Junqiu, E-mail: zhujunqiu@xmut.edu.com [School of Chemical Engineering and Materials Science, Quanzhou Normal University, Quanzhou, Fujian 362000 (China); Zhang, Shuai, E-mail: 601314274@qq.com [College of Materials Science and Engineering, Fuzhou University, Fuzhou, Fujian 350108 (China); Shao, Yanqun, E-mail: yqshao1989@163.com [College of Materials Science and Engineering, Fuzhou University, Fuzhou, Fujian 350108 (China); Lin, Deyuan, E-mail: lindeyuan_fj@126.com [Electric Power Research Institute of State Grid Fujian Electric Power Co. Ltd., Fuzhou 350007 (China); Zhou, Jianfeng, E-mail: 1277018923@qq.com [College of Materials Science and Engineering, Fuzhou University, Fuzhou, Fujian 350108 (China); Chen, Yunxiang, E-mail: rogerchen@163.com [Electric Power Research Institute of State Grid Fujian Electric Power Co. Ltd., Fuzhou 350007 (China); Tang, Dian, E-mail: diantang@fzu.edu.cn [College of Materials Science and Engineering, Fuzhou University, Fuzhou, Fujian 350108 (China)

2017-07-05

Highlights: • Ti/Ru{sub x}Sn{sub 1-x}O{sub 2} electrodes possessed photocatalytic and electrocatalytic activity were prepared by thermal decomposition method. • The effect of electronic structure on electronic conductivity, electrocatalytic and photocatalytic activity were studied. • The photoelectric-synergistic catalytic activity of the Ti/Ru{sub x}Sn{sub 1-x}O{sub 2} electrodes was studied upon UV irradiation. • The Ti/Ru{sub 0.05}Sn{sub 0.95}O{sub 2} electrode has good catalytic activity and excellent stability. - Abstract: DSA-type Ti/Ru{sub x}Sn{sub 1-x}O{sub 2} electrodes were prepared by thermal decomposition method as photoelectrocatalysts (PECs) and extensively characterized by various sophisticated techniques. First-principles calculations was employed to study the effects of Ru content on the electronic structures of the Ru{sub x}Sn{sub 1-x}O{sub 2} coatings. The photoelectric-synergistic catalytic activity of the Ti/Ru{sub x}Sn{sub 1-x}O{sub 2} electrodes was evaluated for the degradation of methyl orange (MO) in aqueous solution. The results show that the RuO{sub 2}−SnO{sub 2} solid solution could be formed. The band gaps of the Ru{sub x}Sn{sub 1-x}O{sub 2} coatings gradually decreased and eventually turned into metallic conductivity with the increase of ruthenium content. As a PEC electrode, reducing band gap is helpful to improve electronic conductivity and the electrocatalytic activity, but not always advantageous to increase the photocatalytic activity. Because too narrow band gap will sacrifice the photogenerated charge carriers and thus reduce photocatalytic activity of the electrode. In our experiments, the rate constant of Ti/Ru{sub 0.05}Sn{sub 0.95}O{sub 2} electrode increased with increasing Ru content and exhibited the maximum rate for 5% Ru loading. The stability test showed the photoelectrocatalytic activity of the Ti/Ru{sub 0.05}Sn{sub 0.95}O{sub 2} electrode almost had no attenuation after 100 h photoelectrolysis, revealing

Atomic scale insights into electrochemical versus gas phase oxidation of HCl over RuO2-based catalysts: A comparative review

International Nuclear Information System (INIS)

Over, Herbert

2013-01-01

In this article our current understanding of the electro-catalyzed chlorine evolution reaction (CER) in comparison with that of the heterogeneously-catalyzed gas phase oxidation of HCl (Deacon process: heterogeneous catalysis) over RuO 2 -based catalysts will be reviewed. Both types of harsh reactions are chemically similar: The main concern is catalyst stability, and in both cases the best catalyst contains RuO 2 as the catalytically active component so that a critical comparison may provide new insights into the underlying physicochemical processes. It is the primary scope of this review addresses atomic scale information on the RuO 2 -catalyzed HCl oxidation reaction either in electrochemical or in gas phase environment. In particular, the involved reaction mechanisms and the reason for the extraordinary stability of RuO 2 under such harsh reaction conditions will be discussed, emphasizing similarities and differences in the Deacon process and the CER and what can be learnt from this comparison. The distinct properties of RuO 2 , which are responsible for its extraordinary catalytic performance in both the CER and the Deacon process, are highlighted

Diaqua-2κ2O-bis(μ-1-oxido-2-naphthoato-1:2κ3O1,O2:O2′;2:3κ3O2:O1,O2′-bis(1-oxido-2-naphthoato-1κ1O2,O2;3κ2O1,O2-hexapyridine-1κ2N,2κ2N,3κ2N-trimanganese(II/III pyridine disolvate dihydrate

Directory of Open Access Journals (Sweden)

Daqi Wang

2008-12-01

Full Text Available The title complex, [Mn3(C11H6O34(C5H5N6(H2O2]·2H2O·2C5H5N, is a trinuclear mixed oxidation state complex of overline1 symmetry. The three Mn atoms are six-coordinated in the shape of distorted octahedra, each coordinated with an O4N2 set of donor atoms, where the ligands exhibit mono- and bidentate modes. However, the coordination of the MnII ion located on the inversion centre involves water molecules at two coordination sites, whereas that of the two symmetry-related MnIII ions involves an O4N2 set of donor atoms orginating from the organic ligands. Intramolecular C—H...π interactions between neighbouring pyridine ligands stabilize this arrangement. A two-dimensional network parallel to (001 is formed by intermolecular O—H...O hydrogen bonds.

Mechanistic Pathway in the Electrochemical Reduction of CO₂ on RuO₂

DEFF Research Database (Denmark)

Karamad, Mohammadreza; Hansen, Heine Anton; Rossmeisl, Jan

2015-01-01

below −0.43 V vs the reversible hydrogen electrode (RHE). On the other hand, at 0.5 ML of CO*, the reduction of formic acid to H2COOH* is the thermodynamically most difficult step and becomes exergonic at potentials below −0.25 V vs RHE. We have found that CO2 reduction activity on RuO2 changes with CO...

Unconventional transport characteristics of p-wave superconducting junctions in Sr2RuO4-Ru eutectic system

International Nuclear Information System (INIS)

Kambara, H.; Kashiwaya, S.; Yaguchi, H.; Asano, Y.; Tanaka, Y.; Maeno, Y.

2010-01-01

We report on novel local transport characteristics of naturally formed p-wave superconducting junctions of Sr 2 RuO 4 -Ru eutectic system by using microfabrication technique. We observed quite anomalous voltage-current (differential resistance-current) characteristics for both I//ab and I//c directions, which are not seen in conventional Josephson junctions. The anomalous features suggest the internal degrees of freedom of the superconducting state, possibly due to chiral p-wave domain. The dc current acts as a driving force to move chiral p-wave domain walls and form larger critical current path to cause the anomalous hysteresis.

Obtention of agricultural gypsum traced on {sup 34} S (Ca{sup 34} SO{sub 4}.2H{sub 2}O), by chemical reaction between H{sub 2}{sup 34} SO{sub 4} and Ca(OH){sub 2}; Obtencao do gesso agricola marcado no {sup 34} S (Ca{sup 34} SO{sub 4}.2H{sub 2}O), por reacao quimica entre o H{sub 2}{sup 34} SO{sub 4} e Ca(OH){sub 2}

Energy Technology Data Exchange (ETDEWEB)

Rossete, Alessandra L.R.M.; Bendassolli, Jose A.; Ignoto, Raquel de Fatima; Batagello, Hugo Henrique [Centro de Energia Nuclear na Agricultura (CENA), Piracicaba, SP (Brazil). Lab. de Isotopos Estaveis

2002-07-01

The gypsum (CaSO{sub 4}.2H{sub 2}O) has double function in the soil: as source of calcium and sulfur and reducing agent of aluminum saturation. The sulfur for the plants has acting in the vital functions and it is proven fact increase of the S deficiency in Brazilian soils. The isotope tracer {sup 34} S can elucidate important aspects in the sulfur cycle. The Ca{sup 34} SO{sub 4}.2H{sub 2}O was obtained by chemical reaction between Ca(OH){sub 2} and H{sub 2}{sup 34} SO{sub 4} solution. The acid was obtained by chromatography ionic change, using cationic resin Dowex 50WX8 and Na{sub 2}{sup 34} SO{sub 4} solution. The reaction was realized under slow agitation. After the reaction, the precipitate was separated and dried in ventilated stove at 60 deg C temperature. The Mass of the Ca{sup 34} SO{sub 4}.2H{sub 2}O produced was determined by method gravimetric. This way, a system contends resin 426 cm{sup 3}, considering volume of 2.2 liters can be obtained a solution contends 44.2 g of H{sub 2}{sup 34} SO{sub 4}, theoretically could be produced 78.0 g of Ca{sup 34} SO{sub 4}.2H{sub 2}O approximately. With results of the tests were verified that there was not total precipitation of the Ca{sup 34}SO{sub 4}.2H{sub 2}O. Were produced 73.7{+-} 0.6 g of Ca{sup 34} SO{sub 4}.2H{sub 2}O representing average income 94.6{+-}0.8 %. The purity of the produced CaSO{sub 4}.2H{sub 2}O was 98%. (author)

Electronic structure of Sr2RuO4 studied by angle-resolved photoemission spectroscopy

International Nuclear Information System (INIS)

Iwasawa, H.; Aiura, Y.; Saitoh, T.; Yoshida, Y.; Hase, I.; Ikeda, S.I.; Bando, H.; Kubota, M.; Ono, K.

2007-01-01

Electronic structure of the monolayer strontium ruthenate Sr 2 RuO 4 was investigated by high-resolution angle-resolved photoemission spectroscopy. We present photon-energy (hν) dependence of the electronic structure near the Fermi level along the ΓM line. The hν dependence has shown a strong spectral weight modulation of the Ru 4d xy and 4d zx bands

Crystallization behavior of (1 - x)Li{sub 2}O.xNa{sub 2}O.Al{sub 2}O{sub 3}.4SiO{sub 2} glasses

Energy Technology Data Exchange (ETDEWEB)

Wang, Moo-Chin [Department of Fragrance and Cosmetic Science, Kaohsiung Medical University, 100 Shih-Chuan 1st Road, Kaohsiung 807, Taiwan (China); Cheng, Chih-Wei; Chang, Kuo-Ming [Department of Mechanical Engineering, National Kaohsiung University of Applied Sciences, 415 Chien-Kung Road, Kaohsiung 80782, Taiwan (China); Hsi, Chi-Shiung, E-mail: chsi@nuu.edu.t [Department of Materials Science and Engineering, National United University, 1 Lien-Da, Kung-Ching Li, Miao-Li 36003, Taiwan (China)

2010-07-02

The crystallization behavior of the (1 - x)Li{sub 2}O.xNa{sub 2}O.Al{sub 2}O{sub 3}.4SiO{sub 2} glasses has been investigated using X-ray diffraction (XRD), scanning electron microscopy (SEM), transmission electron microscopy (TEM), electron diffraction (ED) and energy dispersive spectroscopy (EDS). The crystalline phase was composed of {beta}-spodumene. The isothermal crystallization kinetics of {beta}-spodumene from the (1 - x)Li{sub 2}O.xNa{sub 2}O.Al{sub 2}O{sub 3}.4SiO{sub 2} glasses has also been studied by a quantitative X-ray diffraction method. The activation energy of {beta}-spodumene formation decreases from 359.2 to 317.8 kJ/mol when the Na{sub 2}O content increases from 0 to 0.4 mol and it increases from 317.8 to 376.9 kJ/mol when the Na{sub 2}O content increases from 0.4 to 0.6 mol. The surface nucleation and plate-like growth were dominant in the crystallization of the (1 - x)Li{sub 2}O.xNa{sub 2}O.Al{sub 2}O{sub 3}.4SiO{sub 2} glasses.

Highly Selective Hydrogenation of Levulinic Acid to γ-Valerolactone Over Ru/ZrO2 Catalysts

NARCIS (Netherlands)

Filiz, B.C.; Gnanakumar, E.S.; Martinez-Arias, A.; Gengler, R.; Rudolf, P.; Rothenberg, G.; Shiju, N.R.

We studied the catalytic hydrogenation of levulinic acid over zirconia supported ruthenium catalysts. Four different Ru/ZrO2 catalysts were prepared by different pre-treatments and using different zirconium supports (ZrOx(OH)4−2x and ZrO2). Although the final compositions of the catalysts are the

Highly Selective Hydrogenation of Levulinic Acid to gamma-Valerolactone Over Ru/ZrO2 Catalysts

NARCIS (Netherlands)

Filiz, Bilge Coskuner; Gnanakumar, Edwin S.; Martinez-Arias, Arturo; Gengler, Regis; Rudolf, Petra; Rothenberg, Gadi; Shiju, N. Raveendran

We studied the catalytic hydrogenation of levulinic acid over zirconia supported ruthenium catalysts. Four different Ru/ZrO2 catalysts were prepared by different pre-treatments and using different zirconium supports (ZrOx(OH)(4-2x) and ZrO2). Although the final compositions of the catalysts are the

(η5-Pentamethylcyclopentadienyl(η6-4-phenylbutan-2-oneruthenium(II tetraphenylborate

Directory of Open Access Journals (Sweden)

Bradley T. Loughrey

2010-12-01

Full Text Available The title compound, [Ru(C10H15(C10H12O][B(C6H54], crystallizes as discrete (η5-pentamethylcyclopentadienylRu(η6-4-phenylbutan-2-one]+ cations and [BPh4]− anions. In the cation, the non-H atoms of the butan-2-one group are approximately planar (r.m.s. deviation = 0.056 Å and lie nearly perpendicular to the plane of the phenyl ring with a dihedral angle between the two planes of 69.3 (1°. No significant C—H...O interactions are observed between the methyl and phenyl H atoms and the carbonyl O atom.

Three new d10 transition metal selenites containing PO4 tetrahedron: Cd7(HPO4)2(PO4)2(SeO3)2, Cd6(PO4)1.34(SeO3)4.66 and Zn3(HPO4)(SeO3)2(H2O)

Science.gov (United States)

Ma, Yun-Xiang; Gong, Ya-Ping; Hu, Chun-li; Mao, Jiang-Gao; Kong, Fang

2018-06-01

Three new d10 transition metal selenites containing PO4 tetrahedron, namely, Cd7(HPO4)2(PO4)2(SeO3)2 (1), Cd6(PO4)1.34(SeO3)4.66 (2) and Zn3(HPO4)(SeO3)2(H2O) (3), have been synthesized by hydrothermal reaction. They feature three different structural types. Compound 1 exhibits a novel 3D network composed of 3D cadmium selenite open framework with phosphate groups filled in the 1D helical tunnels. The structure of compound 2 displays a new 3D framework consisted of 2D cadmium oxide layers bridged by SeO3 and PO4 groups. Compound 3 is isostructural with the reported solids of Co3(SeO3)3-x(PO3OH)x(H2O) when x is equal to 1.0. Its structure could be viewed as a 3D zinc oxide open skeleton with SeO3 and HPO4 polyhedra attached on the wall of the tunnels. They represent the only examples in metal selenite phosphates in addition to the above cobalt compounds. Optical diffuse reflectance spectra revealed that these solids are insulators, which are consistent with the results of band structure computations based on DFT algorithm.

Shape and catalytic mechanism of RuO{sub 2} particles at CO oxidation reaction conditions. First-principles based multi-scale modeling

Energy Technology Data Exchange (ETDEWEB)

Reuter, Karsten [TU Muenchen (Germany). Lehrstuhl fuer Theoretische Chemie

2016-11-01

For model catalyst studies on low-index single-crystal surfaces close agreement between detailed measurements and quantitative microkinetic modeling can increasingly be achieved. However, for 'real' catalyst particles, such structure-morphology-activity relationships are only scarcely established. This is prototypically reflected by the situation for RuO{sub 2}, as a most active catalyst for CO oxidation. Here, existing first-principles kinetic modeling is restricted to just one facet, namely the RuO{sub 2}(110) surface, which is not able to fully account for activity data obtained from polycrystalline RuO{sub 2} powder catalysts. The overarching objective of this project was correspondingly to close this gap and demonstrate that similarly close agreement as for individual single-crystal model catalysts can also be achieved for catalyst particles. Specifically, we addressed experiments where an intact RuO{sub 2} bulk structure is conserved, and establish the atomic-scale structure and reactivity of other RuO{sub 2} low-index facets under the gas-phase conditions characteristic for catalytic CO oxidation.

1-Methoxy-3-o-tolylbicyclo[2.2.2]oct-5-ene-2,2-dicarbonitrile

Directory of Open Access Journals (Sweden)

Orhan Büyükgüngör

2009-09-01

Full Text Available In the title compound, C18H18N2O, the cyclohexene and cyclohexane rings of the bicyclo[2.2.2]oct-5-ene unit adopt distorted boat conformations. In the crystal, molecules exist as C—H...N hydrogen-bonded centrosymmetric R22(14 dimers, which are further linked by C—H...π interactions.

Estimation of lattice strain in nanocrystalline RuO2 by Williamson-Hall and size-strain plot methods

Science.gov (United States)

Sivakami, R.; Dhanuskodi, S.; Karvembu, R.

2016-01-01

RuO2 nanoparticles (RuO2 NPs) have been successfully synthesized by the hydrothermal method. Structure and the particle size have been determined by X-ray diffraction (XRD), scanning electron microscopy (SEM), atomic force microscopy (AFM) and transmission electron microscopy (TEM). UV-Vis spectra reveal that the optical band gap of RuO2 nanoparticles is red shifted from 3.95 to 3.55 eV. BET measurements show a high specific surface area (SSA) of 118-133 m2/g and pore diameter (10-25 nm) has been estimated by Barret-Joyner-Halenda (BJH) method. The crystallite size and lattice strain in the samples have been investigated by Williamson-Hall (W-H) analysis assuming uniform deformation, deformation stress and deformation energy density, and the size-strain plot method. All other relevant physical parameters including stress, strain and energy density have been calculated. The average crystallite size and the lattice strain evaluated from XRD measurements are in good agreement with the results of TEM.

Neutron scattering and μSR investigations of quasi-one-dimensional magnetism in the spin =3/2 compound Li3RuO4

DEFF Research Database (Denmark)

Manuel, P.; Adroja, D. T.; Lindgård, Per-Anker

2011-01-01

The S = 3/2, quasi-one-dimensional (1D) zig-zag chain Heisenberg antiferromagnet Li3RuO4 has been investigated using heat capacity, inelastic neutron scattering, neutron diffraction, and μSR measurements on a powder sample. Our neutron diffraction and μSR studies confirm a long-range ordering of ...

Visible light water oxidation using a co-catalyst loaded anatase-structured Ti(1-(5x/4))Nb(x)O(2-y-δ)N(y) compound.

Science.gov (United States)

Breault, Tanya M; Brancho, James J; Guo, Ping; Bartlett, Bart M

2013-08-19

The photocatalytic activity of anatase-structured Ti(1-(5x/4))Nb(x)O(2-y-δ)N(y) (x = 0.25, y = 0.02; NbN-25) was examined for water oxidation under UV and visible light irradiation. The semiconductor was prepared by sol-gel processing followed by nitridation in flowing ammonia and exhibits an indirect optical gap of 2.2 eV. Ti(1-(5x/4))Nb(x)O(2-y-δ)N(y) was loaded with RuO2 by an impregnation technique, and optimized conditions reveal that 1 wt % RuO2 generates 16 μmol O2 from water with concomitant IO3(-) reduction after 3 h of illumination under simulated solar radiation at a flux of 600 mW/cm(2) illumination, which corresponds to 6-sun AM1.5G illumination (compared to no detectible O2 without the RuO2 cocatalyst). A series of cut-on filters shows that the catalyst-loaded semiconductor evolves O2 for λ ≤ 515 nm, and a gas-phase mass spectrometry isotope labeling experiment shows that irradiating an iodate solution in H2(18)O in the presence of 1 wt % RuO2 loaded on NbN-25 gives rise to catalytic water oxidation: both (36)O2 and (34)O2 are observed. It is unclear whether (16)O arises from IO3(-) or surface reconstruction on the photocatalyst, but ICP-AES analysis of the postirradiated solution shows no dissolved metal ions.

[Ru(bpy){sub 3}]{sup 2+}-mediated photoelectrochemical detection of bisphenol A on a molecularly imprinted polypyrrole modified SnO{sub 2} electrode

Energy Technology Data Exchange (ETDEWEB)

Zhang, Bintian [State Key Laboratory of Structures, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences, Fuzhou, Fujian, 350002 (China); Lu, Lili; Huang, Feng [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); Lin, Zhang, E-mail: zlin@fjirsm.ac.cn [State Key Laboratory of Structures, Fujian Institute of Research on the Structure of Matter, Chinese Academy of Sciences, Fuzhou, Fujian, 350002 (China)

2015-08-05

A ruthenium-mediated photoelectrochemical sensor was developed for the detection of BPA, using molecularly imprinted polymers (MIPs) as the recognition element, a tin oxide (SnO{sub 2}) nanoparticle-modified ITO as the electrode, and a blue 473-nm LED as the excitation light source. Photoelectrochemical oxidation of BPA on SnO{sub 2} electrode was achieved by [Ru(bpy){sub 3}]{sup 2+} under the irradiation of light. It was found that BPA was oxidized by Ru{sup 3+} species produced in the photoelectrochemical reaction, resulting in the regeneration of Ru{sup 2+} and the concomitant photocurrent enhancement. MIPs film was prepared by electropolymerization of pyrrole on SnO{sub 2} electrode using BPA as the template. Surface morphology and properties of the as-prepared electrode were characterized by SEM, electrochemical impedance spectroscopy, and photocurrent measurement. In the presence of BPA, an enhanced photocurrent was observed, which was dependent on the amount of BPA captured on the electrode. A detection limit of 1.2 nM was obtained under the optimized conditions, with a linear range of 2–500 nM. Selectivity of the sensor was demonstrated by measuring five BPA analogs. To verify its practicality, this sensor was applied to analyze BPA spiked tap water and river water. With advantages of high sensitivity and selectivity, low-cost instrument, and facile sensor preparation procedure, this sensor is potentially suitable for the rapid monitoring of BPA in real environmental samples. Moreover, the configuration of this sensor is universal and can be extended to organic molecules that can be photoelectrochemically oxidized by Ru{sup 3+}. - Highlights: • [Ru(bpy){sub 3}]{sup 2+}-mediated photoelectrochemical sensor was developed for BPA detection. • Molecularly imprinted polypyrrole was modified on a SnO{sub 2} electrode as the recognition element. • The measurement was realized using a visible light source. • This sensor was highly sensitive and

μ-Oxalato-κ4O1,O2:O1′,O2′-bis[aqua(2,2′-bipyridine-κN(nitrato-κ2O,O′lead(II

Directory of Open Access Journals (Sweden)

Gang-Hong Pan

2012-10-01

Full Text Available The title compound, [Pb2(C2O4(NO32(C10H8N22(H2O2], was synthesized hydrothermally. The binuclear complex molecule is centrosymmetric, the inversion centre being located at the mid-point of the oxalate C—C bond. The PbII ion is heptacoordinated by the O atom of one water molecule, two oxalate O atoms, two nitrate O atoms and two 2,2′-bipyridine N atoms, forming an irregular coordination environemnt. Intermolecular O—H...O hydrogen bonds between water molecules and oxalate and nitrate ions result in the formation of layers parallel to (010. π–π interactions between pyridine rings in adjacent layers, with centroid–centroid distances of 3.584 (2 Å, stabilize the structural set-up.

(η(6)-Benzene)(carbonato-κ(2) O,O')[di-cyclohex-yl(naphthalen-1-ylmeth-yl)phosphane-κP]ruthenium(II) chloro-form tris-olvate.

Science.gov (United States)

Gowrisankar, Saravanan; Neumann, Helfried; Spannenberg, Anke; Beller, Matthias

2014-07-01

The title compound, [Ru(CO3)(η(6)-C6H6){(C6H11)2P(CH2C10H7)}]·3CHCl3, was synthesized by carbonation of [RuCl2(η(6)-C6H6){(C6H11)2P(CH2C10H7)}] with NaHCO3 in methanol at room temperature. The Ru(II) atom is surrounded by a benzene ligand, a chelating carbonate group and a phosphane ligand in a piano-stool configuration. The crystal packing is consolidated by C-H⋯O and C-H⋯Cl hydrogen-bonding inter-actions between adjacent metal complexes and between the complexes and the solvent mol-ecules. The asymmetric unit contains one metal complex and three chloro-form solvent mol-ecules of which only one was modelled. The estimated diffraction contributions of the other two strongly disordered chloro-form solvent mol-ecules were substracted from the observed diffraction data using the SQUEEZE procedure in PLATON [Spek (2009 ▶). Acta Cryst. D65, 148-155].

Electro oxidation of Phenol on a Ti/RuO{sub 2} anode: effect of some electrolysis parameters

Energy Technology Data Exchange (ETDEWEB)

Santos, Iranildes D. dos; Dutra, Achilles J.B. [Universidade Federal do Rio de Janeiro (PEMM/COPPE/UFRJ), RJ (Brazil). Coordenacao dos Programas de Pos-Graduacao de Engenharia. Programa de Engenharia Metalurgica e de Materiais; Afonso, Julio C., E-mail: julio@iq.ufrj.b [Universidade Federal do Rio de Janeiro (IQ/UFRJ), RJ (Brazil). Inst. de Quimica. Dept. de Quimica Analitica

2011-07-01

The influences of electrolysis time, anodic area, current density and supporting electrolyte on phenol and its byproducts degradation on a Ti/RuO{sub 2} anode were investigated. It was observed that phenol and its byproducts were rapidly broken down in the presence of chloride ions. Gas chromatography/mass spectrometry (GC/MS) data have shown that the presence of chloride ions lead to chlorophenols formation, due to reactions with Cl{sub 2} and/or OCl{sup -} generated during electrolysis. However, these intermediate products were also degraded later by the oxidizing agents. The standards established by the CONAMA (Brazilian National Council for the Environment) for phenols and chlorophenols in effluents were achieved after 360 min of electrolysis with a current density of 10 mA cm-2. Cyclic voltammograms obtained with the anodes before and after 436 h of electrolysis under severe salinity conditions (2 mol L-1) and current density (800 mA cm-2) showed that Ti/RuO{sub 2} did not lose its electrocatalytic properties. This fact indicates that Ti/RuO{sub 2} can be used for the treatment of effluents containing phenols in a chloride environment. (author)

The Ruthenostannylene Complex [Cp*(IXy)H2 Ru-Sn-Trip]: Providing Access to Unusual Ru-Sn Bonded Stanna-imine, Stannene, and Ketenylstannyl Complexes.

Science.gov (United States)

Liu, Hsueh-Ju; Ziegler, Micah S; Tilley, T Don

2015-05-26

Reactivity studies of the thermally stable ruthenostannylene complex [Cp*(IXy)(H)2 Ru-Sn-Trip] (1; IXy=1,3-bis(2,6-dimethylphenyl)imidazol-2-ylidene; Cp*=η(5) -C5 Me5 ; Trip=2,4,6-iPr3 C6 H2 ) with a variety of organic substrates are described. Complex 1 reacts with benzoin and an α,β-unsaturated ketone to undergo [1+4] cycloaddition reactions and afford [Cp*(IXy)(H)2 RuSn(κ(2) -O,O-OCPhCPhO)Trip] (2) and [Cp*(IXy)(H)2 RuSn(κ(2) -O,C-OCPhCHCHPh)Trip] (3), respectively. The reaction of 1 with ethyl diazoacetate resulted in a tin-substituted ketene complex [Cp*(IXy)(H)2 RuSn(OC2 H5 )(CHCO)Trip] (4), which is most likely a decomposition product from the putative ruthenium-substituted stannene complex. The isolation of a ruthenium-substituted stannene [Cp*(IXy)(H)2 RuSn(=Flu)Trip] (5) and stanna-imine [Cp*(IXy)(H)2 RuSn(κ(2) -N,O-NSO2 C6 H4 Me)Trip] (6) complexes was achieved by treatment of 1 with 9-diazofluorene and tosyl azide, respectively. © 2015 WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.

3,4-Dibromo-2,2,5,5-tetraphenyl-2,5-dihydrofuran

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Nadine Seidel

2018-04-01

Full Text Available The crystal structure of the title compound, C28H20Br2O, was solved in the orthorhombic space group P212121 with one molecule in the asymmetric unit. The phenyl rings are nearly planar and inclined at angles of 67.7 (1, 68.8 (1, 79.3 (1 and 62.3 (1° to the plane of the 2,5-dihydrofuran ring. The crystal structure features C—H...π and Br...Br interactions, which connect the molecules to a three-dimensional supramolecular network.

The structure of mixed H2O-OH monolayer films on Ru(0001)

Energy Technology Data Exchange (ETDEWEB)

Tatarkhanov, M.; Fomin, E.; Salmeron, M.; Andersson, K.; Ogasawara, H.; Pettersson, L.G.M.; Nilsson, A.; Cerda, J.I.

2008-10-20

Scanning tunneling microscopy (STM) and x-ray absorption spectroscopy (XAS) have been used to study the structures produced by water on Ru(0001) at temperatures above 140 K. It was found that while undissociated water layers are metastable below 140 K, heating above this temperature produces drastic transformations whereby a fraction of the water molecules partially dissociate and form mixed H{sub 2}O-OH structures. XPS and XAS revealed the presence of hydroxyl groups with their O-H bond essentially parallel to the surface. STM images show that the mixed H{sub 2}O-OH structures consist of long narrow stripes aligned with the three crystallographic directions perpendicular to the close-packed atomic rows of the Ru(0001) substrate. The internal structure of the stripes is a honeycomb network of H-bonded water and hydroxyl species. We found that the metastable low temperature molecular phase can also be converted to a mixed H{sub 2}O-OH phase through excitation by the tunneling electrons when their energy is 0.5 eV or higher above the Fermi level. Structural models based on the STM images were used for Density Functional Theory optimizations of the stripe geometry. The optimized geometry was then utilized to calculate STM images for comparison with the experiment.

Surface-enhanced molecularly imprinted electrochemiluminescence sensor based on Ru@SiO2 for ultrasensitive detection of fumonisin B1.

Science.gov (United States)

Zhang, Wei; Xiong, Huiwen; Chen, Miaomiao; Zhang, Xiuhua; Wang, Shengfu

2017-10-15

A novel molecularly imprinted electrochemiluminescence (MIP-ECL) sensor based on Ru(bpy) 3 2+ -doped silica nanoparticles (Ru@SiO 2 NPs) is developed for highly sensitive detection of fumonisin B 1 (FB 1 ). Gold-nanoparticles (AuNPs), Ru@SiO 2 NPs with chitosan (CS) composites and a molecularly imprinted polymer (MIP) are assembled on a glassy carbon electrode (GCE) to fabricate an ECL platform step by step. AuNPs could greatly promote the ECL intensity and improve the analytical sensitivity according to the localized surface plasmon resonance (LSPR) and the electrochemical effect. In this surface-enhanced electrochemiluminescence (SEECL) system, AuNPs work as the LSPR source to improve the ECL intensity and Ru@SiO 2 NPs are used as ECL luminophores. In the phosphate buffer solution (PBS), the evident anodic ECL of Ru@SiO 2 on the above working electrode is observed in the presence of the template molecule fumonisin B 1 (FB 1 ), which could act as the coreactant of Ru@SiO 2 NPs due to the amino group of FB 1 . When the template molecules were eluted from the MIP, little coreactant was left, resulting in an apparent decrease of ECL signal. After the MIP-ECL sensor was incubated in FB 1 solution, the template molecules rebound to the MIP surface, leading to the enhancement of ECL signal again. On the basis of these results, a facile MIP-ECL sensor has been successfully fabricated, which exhibited a linear range from 0.001 to 100ngmL -1 with a detection limit of 0.35pgmL -1 for FB 1 . Moreover, the proposed MIP-ECL sensor displayed an excellent application in real samples. Copyright © 2017 Elsevier B.V. All rights reserved.