A coupled cluster approach with a hybrid treatment of connected triple excitations for bond-breaking potential energy surfaces.
Shen
Jun
J
School of Chemistry and Chemical Engineering, Key Laboratory of Mesoscopic Chemistry of Ministry of Education, Institute of Theoretical and Computational Chemistry, Nanjing University, Nanjing 210093, People's Republic of China.
Xu
Enhua
E
Kou
Zhuangfei
Z
Li
Shuhua
S