Ab initio calculations on accurate dissociation energy,equilibrium geometry, and analytic potential energy function for
The accurate dissociation energy and equilibrium geometry of the b3П state of 7LiH molecule is calculated using a symmetry-adapted-cluster configuration-interaction method in full active space.
作 者: Deheng Shi Yufang Liu Jinfeng Sun Zunlue Zhu Xiangdong Yang 作者单位: Deheng Shi(College of Physics & Electronic Engineering, Xinyang Normal University, Xinyang 464000;College of Physics & Information Engineering, Henan Normal University,Xinxiang 453007;Institute of Atomic and Molecular Physics, Sichuan University, Chengdu 610065)Yufang Liu(College of Physics & Information Engineering, Henan Normal University, Xinxiang 453007)
Jinfeng Sun,Zunlue Zhu(College of Physics & Information Engineering, Henan Normal University, Xinxiang 453007;Institute of Atomic and Molecular Physics, Sichuan University, Chengdu 610065)
Xiangdong Yang(Institute of Atomic and Molecular Physics, Sichuan University, Chengdu 610065)
刊 名: 中国光学快报(英文版) EI SCI 英文刊名: CHINESE OPTICS LETTERS 年,卷(期): 2005 3(12) 分类号: 关键词: