Title of article :
Quantum chemical study on complexes of the LiH molecule with e+, Ps and Ps− including correlation energy
Author/Authors :
Strasburger، نويسنده , , K.، نويسنده ,
Issue Information :
روزنامه با شماره پیاپی سال 1996
Abstract :
SCF and CI energies of the LiH, LiH−, e+LiH, LiHPs and LiHPs− systems have been evaluated in the extended basis set at the experimental geometry of LiH. Electron and positron affinities of the LiH molecule have been compared. The results indicate the importance of the correlation energy in positron-molecule complexes.
Journal title :
Chemical Physics Letters
Journal title :
Chemical Physics Letters