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X-ray spectroscopic studies of the electronic structural of transition-metal complex compounds

Research Project

Project/Area Number 03640296
Research Category

Grant-in-Aid for General Scientific Research (C)

Allocation TypeSingle-year Grants
Research Field 固体物性
Research InstitutionUtsunomiya University

Principal Investigator

SUGIURA Chikara  Utsunomiya University, Faculty of Engineering, Professor, 工学部, 教授 (20006406)

Co-Investigator(Kenkyū-buntansha) YORIKAWA Hiroharu  Utsunomiya University, Faculty of Engineering, Research Assistant, 工学部, 助手 (40220777)
MURAMATSU Shinji  Utsunomiya University, Faculty of Engineering, Associate Professor, 工学部, 助教授 (90008053)
Project Period (FY) 1991 – 1992
Project Status Completed (Fiscal Year 1992)
Budget Amount *help
¥2,100,000 (Direct Cost: ¥2,100,000)
Fiscal Year 1992: ¥400,000 (Direct Cost: ¥400,000)
Fiscal Year 1991: ¥1,700,000 (Direct Cost: ¥1,700,000)
KeywordsTransition-metal compounds / Calcium compounds / X-ray emission spectra / X-ray absorption spectra / Molecular orbital / Electronic structure / Chemical shift / Cross transition / 含水金属塩化物 / クロス遷移 / 遷移金属錯体 / 光電子スペクトル / 電気陰性度 / 伝導帯
Research Abstract

The purpose of this project is to show the X-ray Kalpha, Kbeta and Lbeta_<2,15> emission spectra from transition-metal complex compounds and various metal compounds along with the X-ray K and L absorption spectra reported previously and to obtain information on their electronic structures. The results obtained are as follows:
A. The FWHM of the F Kalpha_<1,2> emission bands of 3d transition-metal fluorides MF_2 (M = Mn, Fe, Co, Ni, Cu, Zn) is closely related to the difference in electro negativity between the metal and fluorine atoms. The structures at the F K absorption edges are interpreted in terms of a molecular orbital model.
B. The S Kbeta emission and S K absorption-edge spectra of TiS_2, ZrS_2 and HfS_2 are compared with theoretical DOS cures of these compounds. There is good agreement between them. The relative intensities of absorption peaks at the K edges depend on the degree of covalent mixing of the metal d and sulfur 3p states.
C. The Pd Lbeta_<2,15> emission spectra of PdCl_2, Pd(ac)_2 and Pd(acac)_2 consist of a prominent peak with a high-energy structure and are alike, in contrast to the case of the Pd L_<III> absorption spectra of these compounds reported previously. The Pd Lbeta_<2,15> emission, Pd L_<III> absorption, Cl Kbeta emission and Cl K absorption spectra of PdCl_2 are interpreted in terms of the MOs of square-planar complex [PdCl_4]^<2->.
D. Chemical shifts are observed for the Ca^<2+> Kalpha_<1,2>, Kbeta_<1,3> and Kbeta_5 emission peaks of CaF_2, CaO and CaS. The Kbeta_5 bands are attributed to the cross transition from the anion p-like valence band to the Ca^<2+> 1s level.

Report

(3 results)
  • 1992 Annual Research Report   Final Research Report Summary
  • 1991 Annual Research Report
  • Research Products

    (18 results)

All Other

All Publications (18 results)

  • [Publications] C.SUGIURA: "Kα X-ray emission spectra and K X-ray absorption-edge structures of fluorine in 3d transition-metal difluorides." Journal of the Physical Society of Japan. 60. 2710-2717 (1991)

    • Description
      「研究成果報告書概要(和文)」より
    • Related Report
      1992 Final Research Report Summary
  • [Publications] C.SUGIURA: "Kβ X-ray eission band and K X-ray absorption-edge structure of sulfur in layered transition-metal compounds TiS_2,ZrS_2 and HfS_2." Japanese Journal of Applied Physics. 30. 1742-1745 (1991)

    • Description
      「研究成果報告書概要(和文)」より
    • Related Report
      1992 Final Research Report Summary
  • [Publications] C.SUGIURA: "X-ray spctroscopic investigation of valence bands of Pdcl_2,Pd(ac)_2 and Pd(acac)_2." Japanese Journal of Applied Physics. 30. 3432-3436 (1991)

    • Description
      「研究成果報告書概要(和文)」より
    • Related Report
      1992 Final Research Report Summary
  • [Publications] C.SUGIURA: "Fluorine Kα X-ray emission spectra of sectra of selected metal fluorides." Japanese Jouranal of Applied Physics. 31. 311-316 (1992)

    • Description
      「研究成果報告書概要(和文)」より
    • Related Report
      1992 Final Research Report Summary
  • [Publications] C.SUGIURA: "Chlorine kβ X-ray emission spectra of hydrated metal chlorides" Journal of Physics and Chemistry of Solida. 53. 1049-1053 (1992)

    • Description
      「研究成果報告書概要(和文)」より
    • Related Report
      1992 Final Research Report Summary
  • [Publications] C.SUGIURA: "X-ray spectroscopiC STUDIES of CaF_2,CaO and CaS" Japanese Journal of Applied Physics. 31. 2816-2821 (1992)

    • Description
      「研究成果報告書概要(和文)」より
    • Related Report
      1992 Final Research Report Summary
  • [Publications] C. Sugiura: "Kalpha X-ray Emission spectra and K X-ray absorption-edge structures of fluorine in 3d transition-metal difluorides" J. Phys. Soc.60. 2710-2717 (1991)

    • Description
      「研究成果報告書概要(欧文)」より
    • Related Report
      1992 Final Research Report Summary
  • [Publications] C. Sugiura: "Kbeta X-ray emission band and X-ray absorption-edge structure of sulfur in layered transition-metal compounds TiS_2, ZrS_2 and HfS_2" Jpn. J. APPI. Phys.30. 1742-1745 (1991)

    • Description
      「研究成果報告書概要(欧文)」より
    • Related Report
      1992 Final Research Report Summary
  • [Publications] C. Sugiura: "X-ray spectroscopic investigation of valence bands of PdCl_2, Pd(ac)_2 and Pd(acac)_2" Jpn. J. APPI. Phys.30. 3432-3436 (1991)

    • Description
      「研究成果報告書概要(欧文)」より
    • Related Report
      1992 Final Research Report Summary
  • [Publications] C. Sugiura: "Fluorine Kalpha X-ray emission spectra of selected metal fluorides" Jpn. J. APPI. Phys.31. 311-316 (1992)

    • Description
      「研究成果報告書概要(欧文)」より
    • Related Report
      1992 Final Research Report Summary
  • [Publications] C. Sugiura: "Chlorine Kbeta X-ray emission spectra of hydrated metal chlorides" J. Phys. Chem. Solids. 53. 1049-1053 (1992)

    • Description
      「研究成果報告書概要(欧文)」より
    • Related Report
      1992 Final Research Report Summary
  • [Publications] C. Sugiura: "X-ray spectroscopic studies of CaF_2, CaO and CaS" Jpn. J. APPI. Phys.31. 2816-2821 (1992)

    • Description
      「研究成果報告書概要(欧文)」より
    • Related Report
      1992 Final Research Report Summary
  • [Publications] C.Sugiura: "Chlorine Kβ x-ray emission spectra of hydrated metal chlorides" Journal of Physics and Chemistry of Solids. 53. 1049-1053 (1992)

    • Related Report
      1992 Annual Research Report
  • [Publications] C.Sugiura: "X-ray spectroscopic studies of CaF_2,CaO and CaS" Japanese Journal of Applied Physics. 31. 2816-2821 (1992)

    • Related Report
      1992 Annual Research Report
  • [Publications] C.Sugiura: "Kα Xーray emission spectra and K Xーray absorptionーedge structures of fluorine in 3d transitionーmetal difluorides." Journal of the Physical Society of Japan. 60. 2710-2717 (1991)

    • Related Report
      1991 Annual Research Report
  • [Publications] C.Sugiura: "Kβ Xーray emission band and K Xーray absorptionーedge structure of sulfur in layered transitionーmetal compounds TiS_2,ZnS_2 and HfS_2." Japanese Journal of Applied Physics. 30. 1742-1745 (1991)

    • Related Report
      1991 Annual Research Report
  • [Publications] C.Sugiura: "Xーray spectroscopic Investigation of valence bands PdCl_2,Pd(ac)_2 and Pd(acac)_2." Japanese Journal of Applied Physics. 30. 3432-3436 (1991)

    • Related Report
      1991 Annual Research Report
  • [Publications] C.Sugiura: "Fluorine Kα Xーray emission spectra of selected metal fluorides." Japanese Journal of Applied Physics. 31. 311-316 (1992)

    • Related Report
      1991 Annual Research Report

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Published: 1991-04-01   Modified: 2016-04-21  

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