CALCULATION OF POSITRONIUM COMPOUNDS, PSLI, PSF, AND PSCL, BY 2ND-ORDER VARIATIONAL PERTURBATION METHOD

被引:27
作者
SAITO, SL
机构
[1] Department of Chemistry, Faculty of Science, Hokkaido University, Sapporo
关键词
D O I
10.1016/0009-2614(95)00954-3
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
Correlation, positron ionization, and positronium (Ps) binding energies for the ground state (S-2,S-1) Of PsLi, PsF, and PsCl together with the excited state (P-2,P-1) of PsF and PsCl are calculated by the second-order variational perturbation method with partial wave expansion. Estimated positronium binding energies for PsLi(S-2,S-1), PsF(S-2,S-1), PsCl(S-2,S-1), PsF(P-2,P-1), and PsCl(P-2,P-1) are -2.19, 2.24, 1.62, -0.16, and -0.05 eV, respectively. The Ps binding energies of PsF(S-2,S-1) and PsCl(S-2,S-1) are in good agreement with the ones estimated by quantum Monte Carlo calculation and also with experimental ones.
引用
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页码:54 / 58
页数:5
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