Cluster structure prediction via CALYPSO method

Cluster structure prediction via CALYPSO method

Tian Yonghong¹, Sun Weiguo², Chen Bole², Jin Yuanyuan¹, Lu Cheng^{1, 3, 4, ‡}

Chemical bonding pattern of TaB 12 − cluster analyzed by ADNDP method. Adapted with permission from Ref. [33]. Copyright 2018 American Chemical Society.