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Hartree-Fock approach to localisation and valence transition in rare-earth materials

✍ Scribed by A. Bringer


Book ID
103809259
Publisher
Elsevier Science
Year
1985
Weight
510 KB
Volume
130
Category
Article
ISSN
0378-4363

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Hartree-Fock difference approach to chem
✍ Roman F. Nalewajski; Janusz Mrozek πŸ“‚ Article πŸ“… 1996 πŸ› John Wiley and Sons 🌐 English βš– 979 KB

The recently introduced set of quadratic ionic and covalent valence indices from changes in the pair-diagonal part of the molecular (Hartree-Fock) two-electron density matrix, A r(')(a, b) (orthogonal atomic orbital [OAO] basis set), relative to separated atoms limit (SAL), is extended to cubic vale