The diagonal Born–Oppenheimer correction beyond the Hartree–Fock approximation
作者： Edward F. Valeev , C. David Sherrill
DOI: 10.1063/1.1540626
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摘要: We report on evaluation of the diagonal Born–Oppenheimer correction (DBOC) to the electronic energy with Hartree–Fock (HF) and conventional correlated wave functions for general …
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