First-principles investigation into the structural stability of icosahedral Ti12X clusters (X = B, C, N, Al, Si, P, V, Cr, Mn, Fe, Co and Ni)

Journal of Physics B: Atomic, Molecular and Optical Physics

Volumn 35, Issue 19, 2002, Pages 4015-4019

  Wang, Shan Ying ^a   Duan, Wenhui ^a   Wang, Chong Yu ^a  

^a TSINGHUA UNIVERSITY   (China)

Author keywords

[No Author keywords available]

Indexed keywords

BINDING ENERGY; ELECTRONIC STRUCTURE; ENERGY GAP; NEGATIVE IONS; PROBABILITY DENSITY FUNCTION; RELAXATION PROCESSES; TITANIUM COMPOUNDS;

MOLECULAR ORBITALS;

MOLECULAR PHYSICS;

EID: 0037078141     PISSN: 09534075     EISSN: None     Source Type: Journal    
DOI: 10.1088/0953-4075/35/19/305     Document Type: Article

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