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International Journal of Quantum Chemistry

Volumn 90, Issue 1, 2002, Pages 244-249

Highly accurate Gaussian basis sets for some 14-electron diatomic systems

(3) Canal Neto, A a Jorge, F E a Centoducatte, R a

a FEDERAL UNIVERSITY OF ESPÍRITO SANTO (Brazil)

Author keywords

Gaussian basis sets; Molecular improved generation coordinate Hartree Fock method; Multipole electric moments; Total energies

Indexed keywords

COMPUTATIONAL METHODS; GROUND STATE; MATHEMATICAL TRANSFORMATIONS; OPTIMIZATION; QUANTUM THEORY;

MULTIPOLE ELECTRIC MOMENTS;

MOLECULAR DYNAMICS;

EID: 0037026918 PISSN: 00207608 EISSN: None Source Type: Journal
DOI: 10.1002/qua.10106 Document Type: Article

Times cited : (6)

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* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.