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Journal of Molecular Structure: THEOCHEM

Volumn 584, Issue 1-3, 2002, Pages 1-4

Proper basis set for quantum mechanical studies of potential energy surfaces of carbohydrates

(1) Csonka, G I a

a BUDAPEST UNIVERSITY OF TECHNOLOGY AND ECONOMICS (Hungary)

Author keywords

B3LYP method; Basis sets; Total energy; L fucose conformers; D glucose conformers

Indexed keywords

CARBOHYDRATE; FUCOSE; GLUCOSE; HYDROGEN; WATER;

DIFFUSION; ENERGY; QUANTUM MECHANICS; REVIEW; STANDARD; TECHNIQUE;

EID: 0037177716 PISSN: 01661280 EISSN: None Source Type: Journal
DOI: 10.1016/S0166-1280(02)00096-9 Document Type: Review

Times cited : (107)

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* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.