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The cage-like structure enhanced magnetic moment in ScKn (n=2-12) clusters: A first-principles jointed particle swarm optimization investigation

Aireti, M; Jiang, Y; Cao, HB; Duan, HM; Cui, XH; Jing, Q; Xue, X

Jiang, Y (corresponding author), Xinjiang Univ, Sch Phys Sci & Technol, Urumqi 830046, Peoples R China.; Xue, X (corresponding author), East China Normal Univ, Dept Phys, Shanghai 200241, Peoples R China.

INTERNATIONAL JOURNAL OF QUANTUM CHEMISTRY, 2021; 121 (14):

Abstract

Using the first principles method combined with the CALYPSO structure prediction method, the authors have investigated the geometries of the lowest-en......

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