Literature DB >> 23020161

Born-Oppenheimer and non-Born-Oppenheimer, atomic and molecular calculations with explicitly correlated Gaussians.

Sergiy Bubin1, Michele Pavanello, Wei-Cheng Tung, Keeper L Sharkey, Ludwik Adamowicz.   

Abstract

Year:  2012        PMID: 23020161     DOI: 10.1021/cr200419d

Source DB:  PubMed          Journal:  Chem Rev        ISSN: 0009-2665            Impact factor:   60.622


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  2 in total

1.  On the physical interpretation of the nuclear molecular orbital energy.

Authors:  Jorge Charry; Laura Pedraza-González; Andrés Reyes
Journal:  J Chem Phys       Date:  2017-06-07       Impact factor: 3.488

2.  The any particle molecular orbital/molecular mechanics approach.

Authors:  José M Rodas; Johan F Galindo; Adrian E Roitberg; Andrés Reyes
Journal:  J Mol Model       Date:  2019-09-16       Impact factor: 1.810

  2 in total

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