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Japanese Journal of Applied Physics

Volumn 50, Issue 1 PART 3, 2011, Pages

Density functional theory study of the interaction of magnesium ions with graphene chip

(3) Kato, Koichi a Iyama, Tetsuji a Tachikawa, Hiroto a

a HOKKAIDO UNIVERSITY (Japan)

Author keywords

[No Author keywords available]

Indexed keywords

B3LYP/6-31G; CHARGE TRANSFER BANDS; DENSITY FUNCTIONAL THEORY METHODS; DFT CALCULATION; EXCITATION BANDS; HEXAGONAL SITES; HIGHEST OCCUPIED MOLECULAR ORBITAL; IONIC SPECIES; LOWEST UNOCCUPIED MOLECULAR ORBITAL; MAGNESIUM ATOM; MAGNESIUM IONS; SINGLY OCCUPIED MOLECULAR ORBITALS; THEORETICAL RESULT; TIME-DEPENDENT;

CHARGE TRANSFER; DENSITY FUNCTIONAL THEORY; ION EXCHANGE; MAGNESIUM; METAL IONS; MOLECULAR MODELING; MOLECULAR ORBITALS; ORBITAL TRANSFER;

GRAPHENE;

EID: 79955127254 PISSN: 00214922 EISSN: 13474065 Source Type: Journal
DOI: 10.1143/JJAP.50.01BJ01 Document Type: Conference Paper

Times cited : (8)

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* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.