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Volumn 48, Issue 13, 2009, Pages 5602-5604

Structural and dynamic properties of BalnGeH: A rare solid-state indium hydride

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Indexed keywords


EID: 67649947495     PISSN: 00201669     EISSN: None     Source Type: Journal    
DOI: 10.1021/ic9005423     Document Type: Article
Times cited : (13)

References (29)
  • 2
    • 67649975251 scopus 로고    scopus 로고
    • Chemistry of Aluminum, Gallium, Indium, and Thallium; Downs, A. J., Ed.; Blackie Academic: London, 1993.
    • Chemistry of Aluminum, Gallium, Indium, and Thallium; Downs, A. J., Ed.; Blackie Academic: London, 1993.
  • 14
    • 84869365751 scopus 로고    scopus 로고
    • All steps of the synthesis and sample preparation for diffraction experiments were carried out under dry argon. Ba (99.9, Aldrich, In (99.9, Aldrich, and Ge (99.999, Alfa Aesar) were used as received. The starting material BalnGe was prepared by arc-melting (low current arc) stoichiometric amounts of the pure elements. For hydrogenation, a cold-pressed pellet of BalnGe was loaded into a corundum crucible and placed into a stainless steel autoclave. The reaction was carried out at 300 °C for 3 days and a hydrogen pressure of 80 bar. BalnGeD was prepared analogously but at 275 °C. BalnGe, BalnGeH, and BalnGeD were characterized by powder X-ray diffraction Siemens D5000, Bragg, Brentano geometry; Cu Ka radiation; Si standard, BalnGe has a metallic luster, while the hydride and deuteride are dullish gray. All compounds react slowly with air/moisture, yielding a black, amorphous material
    • All steps of the synthesis and sample preparation for diffraction experiments were carried out under dry argon. Ba (99.9%, Aldrich), In (99.9%. Aldrich). and Ge (99.999%. Alfa Aesar) were used as received. The starting material BalnGe was prepared by arc-melting (low current arc) stoichiometric amounts of the pure elements. For hydrogenation, a cold-pressed pellet of BalnGe was loaded into a corundum crucible and placed into a stainless steel autoclave. The reaction was carried out at 300 °C for 3 days and a hydrogen pressure of 80 bar. BalnGeD was prepared analogously but at 275 °C. BalnGe, BalnGeH, and BalnGeD were characterized by powder X-ray diffraction (Siemens D5000, Bragg - Brentano geometry; Cu Ka radiation; Si standard). BalnGe has a metallic luster, while the hydride and deuteride are dullish gray. All compounds react slowly with air/moisture, yielding a black, amorphous material.
  • 17
    • 67649978263 scopus 로고    scopus 로고
    • Atomic positions of BaInGcD were determined by Rietveld analysis of neutron powder diffraction data using the programs GSAS and EXPGUI. Time-of-flight neutron diffraction data were collected at 12 and 300 K on the neutron powder diffractometer at the Lujan Neutron Scattering Center at Los Alamos National Laboratory
    • (a) Atomic positions of BaInGcD were determined by Rietveld analysis of neutron powder diffraction data using the programs GSAS and EXPGUI. Time-of-flight neutron diffraction data were collected at 12 and 300 K on the neutron powder diffractometer at the Lujan Neutron Scattering Center at Los Alamos National Laboratory.
  • 23
    • 67649993954 scopus 로고    scopus 로고
    • Total energy calculations for BalnGeH were performed in the framework of the frozen-core all-electron projected augmented wave method, as implemented in the program VASP
    • (a) Total energy calculations for BalnGeH were performed in the framework of the frozen-core all-electron projected augmented wave method, as implemented in the program VASP.
  • 28
    • 84869343871 scopus 로고    scopus 로고
    • 1H NMR resonance of adamamane to 1.63 ppm.
    • 1H NMR resonance of adamamane to 1.63 ppm.
  • 29
    • 67649981411 scopus 로고    scopus 로고
    • BaTrGcH samples for INS spectroscopy were loaded into scaled aluminum sample holders under a helium atmosphere. The spectra were measured at 10 K on the filter difference spectrometer instrument at the Lujan Center at Los Alamos National Laboratory. Data were treated by discrete, direct deconvolution of the instrument resolution function, which provides an energy resolution on the order of 4-5
    • BaTrGcH samples for INS spectroscopy were loaded into scaled aluminum sample holders under a helium atmosphere. The spectra were measured at 10 K on the filter difference spectrometer instrument at the Lujan Center at Los Alamos National Laboratory. Data were treated by discrete, direct deconvolution of the instrument resolution function, which provides an energy resolution on the order of 4-5%.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.