The interaction potentials for He-He and He-Li +
1984; Taylor & Francis; Volume: 53; Issue: 1 Linguagem: Inglês
10.1080/00268978400102241
ISSN1362-3028
AutoresHiroshi Tatewaki, Kiyoshi Tanaka, Yuichi Ohno, Takashi Nakamura,
Tópico(s)Advanced Chemical Physics Studies
ResumoThe He-He and He-Li+ potentials are investigated by means of extensive STO SCF and configuration interaction calculations. The calculated molecular constants r m and εm are 5·61 a.u. and 9·81 K for He-He which are very close to experiment. The calculated potential curve for He-Li+ is also considered to be reliable; r m=3·63 a.u. and εm=0·072 eV.
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