We systematically study the magnetism and stability of monodoped and codoped ZnO bulks with 3d transition metal (TM = Sc,Ti,V,Cr) or nonmagnetic 2p light elemen
The crystal structures and the visible light absorption properties of 3,4:9,10-perylene tetracarboxylic acid bisimide (PBI) derivates are investigated theoretic
Liouville space hierarchical equation of motion (HEOM) method1-4 is recently developed to calculate the quantum rate dynamics.In our work,we apply HEOM equation
The photoisomerization mechanisms of bridged azobenzene are investigated by means of surface hopping dynamics simulations based on the Zhu-Nakamura theory.In th