Title of article :
Comment on `Potential energy surfaces of excited states of H2−ʹ (Chem. Phys. Lett. 285 (1998) 114–120)
Author/Authors :
Stibbe، نويسنده , , Darian T and Tennyson، نويسنده , , Jonathan، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 1999
Abstract :
The H2− excited state potential curves of Mebel et al. (Chem. Phys. Lett. 285 (1998) 114–120) are re-analysed. They are shown to be artefacts of the method of computation, with little or no relation to real states. The need for caution in the use of bound state electronic structure methods to study resonance parameters is re-emphasized.
Journal title :
Chemical Physics Letters
Journal title :
Chemical Physics Letters