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Circulant orbitals and the electron-correlation problem

Circulant, as well as canonical, orbitals are used in the different orbitals for different spins method for treating electron correlation. Circulant orbitals provide a theoretical justification for the use of a single parameter, even when the canonical orbitals have widely different orbital energies...

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Bibliografiska uppgifter
Huvudupphovsmän: Pauncz, Ruben, Chen, Min-Bo, Parr, Robert G.
Materialtyp: Artigo
Språk:Inglês
Publicerad: 1982
Ämnen:
Länkar:https://ncbi.nlm.nih.gov/pmc/articles/PMC345816/
https://ncbi.nlm.nih.gov/pubmed/16593152
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