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International Journal of Quantum Chemistry

Volumn 89, Issue 4, 2002, Pages 237-247

Distributed Gaussian basis sets: Variationally optimized s-type sets for H2, LiH, and BH

(3) Quiney, H M a Glushkov, V N b Wilson, S c

a UNIVERSITY OF MELBOURNE (Australia)

b OLES HONCHAR DNIPRO NATIONAL UNIVERSITY (Ukraine)

c RUTHERFORD APPLETON LABORATORY (United Kingdom)

Author keywords

Basis sets; Distributed Gaussian basis sets; Finite basis set Hartree Fock; Finite difference Hartree Fock; Gaussian basis sets

Indexed keywords

ELECTRONIC STRUCTURE; FINITE DIFFERENCE METHOD; GROUND STATE; MOLECULAR STRUCTURE; MOLECULES; NUMERICAL ANALYSIS; OPTIMIZATION; QUANTUM THEORY;

DISTRIBUTED GAUSSIAN BASIS SETS; HARTREE-FOCK GROUND STATES; LITHIUM HYDRIDE;

MOLECULAR DYNAMICS;

EID: 0037026317 PISSN: 00207608 EISSN: None Source Type: Journal
DOI: 10.1002/qua.10295 Document Type: Conference Paper

Times cited : (28)

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* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.