書誌事項
- タイトル別名
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- Electron Density Analysis and Chemical Reactions
- デンシ ミツド カイセキ ト ハンノウセイ
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説明
The recnt advances in X-ray determination of electron distribution in transition metal complexes are summarized in connection with possible applications of the technique to studies on mechanisms of chemical reactions.<BR>The effects of the ligand field symmetry on the d electron distribution were already observed in crystals of CoAl2O4, γ-Fe2SiO4 and FeS2 with the X-ray diffraction method. Using the aspherical scattering factors (ASF) of electrons in 3dyz, 3dxy, 3dz2and 3dx2-y2orbitals, the spin-states of transition metals in KMnF3and KCoF3crystals were determined equivocally. The wave functions for 3d electrons of the Cu atom in Jahn-Teller distorted KCuF3 crystals wese determined with ASF in a good approximation.<BR>These successes imply that the X-ray analysis with ASF can be effectively applied to the studies on chemical reactions, such as oxidation-reduction reactions where changes of the spin states are essential and catalytic reactions of transition metals where the spatial relations of the a electron lobes are important, and so on.
収録刊行物
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- 日本結晶学会誌
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日本結晶学会誌 24 (1), 9-17, 1982
日本結晶学会
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詳細情報 詳細情報について
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- CRID
- 1390001204085637888
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- NII論文ID
- 130000784294
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- NII書誌ID
- AN00188364
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- ISSN
- 18845576
- 03694585
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- NDL書誌ID
- 2437168
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- 本文言語コード
- ja
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- データソース種別
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- JaLC
- NDL
- Crossref
- CiNii Articles
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- 抄録ライセンスフラグ
- 使用不可