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Journal of Chemical Physics

Volumn 130, Issue 18, 2009, Pages

Competition between structural distortion and magnetic moment formation in fullerene C20

(4) Han, Myung Joon a Kim, Gunn b Lee, Jae Il c Yu, Jaejun b

a UNIVERSITY OF CALIFORNIA (United States)

b Seoul National University (South Korea)

c Inha University (South Korea)

Author keywords

[No Author keywords available]

Indexed keywords

COULOMB CORRECTIONS; COULOMB INTERACTION PARAMETERS; DENSITY FUNCTIONAL THEORY CALCULATIONS; EXCHANGE-CORRELATION POTENTIAL; FULLERENE C; GROUND STATE CONFIGURATION; HIGH SYMMETRY; JAHN TELLER DISTORTIONS; LDA + U; MAGNETIC GROUND STATE; MAGNETIC INSTABILITY; MOMENT FORMATION; NONMAGNETIC STATE; SPIN CONFIGURATIONS; STRUCTURAL DISTORTIONS; TOTAL ENERGY;

COMPETITION; COULOMB INTERACTIONS; FULLERENES; GROUND STATE; MAGNETIC MOMENTS;

DENSITY FUNCTIONAL THEORY;

EID: 67249141098 PISSN: 00219606 EISSN: None Source Type: Journal
DOI: 10.1063/1.3119485 Document Type: Article

Times cited : (13)

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