화학공학소재연구정보센터
Journal of Physical Chemistry A, Vol.108, No.6, 1052-1056, 2004
Electronic structure of LiH+ revisited by a model potential-type method
A theoretical study of the electronic structure of LiH (+) is reported. Potential energy curves and dipole moments for the ground and numerous electronic excited states have been computed in the framework of a model potential type method. Spectroscopic constants have been determined for the lowest bound states, and they are compared with available theoretical values. Static dipole polarizabilities are presented for the two lowest states.