Ab Initio Calculations of the Electron-Transfer Matrix Element in CuI−CuII Mixed-Valence Compounds
Author:
Affiliation:
1. Contribution from the Departamento de Química Física, Facultad de Química, Universidad de Sevilla, E−41012, Sevilla, Spain
Publisher
American Chemical Society (ACS)
Subject
Colloid and Surface Chemistry,Biochemistry,General Chemistry,Catalysis
Link
https://pubs.acs.org/doi/pdf/10.1021/ja972454a
Reference46 articles.
1. Tetraethylammonium tetrachlorodicuprate(1-): an ordered, mixed valence (Cu2Cl4)nn-chain
2. Detailed spectroscopic analysis of half-met hemocyanins: mixed-valent contributions to electronic properties and structure
3. The Electronic Structure of CuA: A Novel Mixed-Valence Dinuclear Copper Electron-Transfer Center
4. The Purple Mixed-Valence CuA Center in Nitrous-oxide Reductase: EPR of the Copper-63-, Copper-65-, and Both Copper-65- and [15N]Histidine-Enriched Enzyme and a Molecular Orbital Interpretation
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