TY - JOUR
T1 - Stable disordered structures of vanadium clusters
AU - Taneda, Akito
AU - Shimizu, Toshio
AU - Kawazoe, Yoshiyuki
PY - 2001/4/23
Y1 - 2001/4/23
N2 - Tight-binding and self-consistent tight-binding molecular dynamics are performed to determine the stable structures of Vnn (n = 2-17, 55, 147 and 309). The globally optimized structures of V2-V9 are in good agreement with first-principles results. For V15-V309, amorphous-like disordered structures are found. The stability of the disordered clusters are discussed from the viewpoint of the local energy distribution in V55.
AB - Tight-binding and self-consistent tight-binding molecular dynamics are performed to determine the stable structures of Vnn (n = 2-17, 55, 147 and 309). The globally optimized structures of V2-V9 are in good agreement with first-principles results. For V15-V309, amorphous-like disordered structures are found. The stability of the disordered clusters are discussed from the viewpoint of the local energy distribution in V55.
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U2 - 10.1088/0953-8984/13/16/101
DO - 10.1088/0953-8984/13/16/101
M3 - Article
AN - SCOPUS:0035937940
SN - 0953-8984
VL - 13
SP - L305-L312
JO - Journal of Physics Condensed Matter
JF - Journal of Physics Condensed Matter
IS - 16
ER -