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Volumn 18, Issue 6, 1997, Pages 775-795

Molecular energies and properties from density functional theory: Exploring basis set dependence of Kohn-Sham equation using several density functionals

Author keywords

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Indexed keywords


EID: 0000105025     PISSN: 01928651     EISSN: None     Source Type: Journal    
DOI: 10.1002/(SICI)1096-987X(19970430)18:6<775::AID-JCC4>3.0.CO;2-P     Document Type: Article
Times cited : (139)

References (84)
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    • Complete tables of molecular energies, geometries, and dipole moments as well as energies of reaction for all reactions considered in the present study may be obtained as Supplementary Material from the Journal of Computational Chemistry.
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* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.