Article ID Journal Published Year Pages File Type
5388422 Chemical Physics Letters 2007 5 Pages PDF
Abstract
Geminal mean field configuration interaction method, removing Hartree-Fock orbitals arbitrariness, better guess geminals, separate analysis of occupied orbitals optimisation and virtual orbitals optimisation.
Related Topics
Physical Sciences and Engineering Chemistry Physical and Theoretical Chemistry
Preview
The electronic mean field configuration interaction method: II - Improving guess geminals
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