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Hyperspherical Calculations on Electron Affinity and Geometry for Li^- and Na^-

Hyperspherical Calculations on Electron Affinity and Geometry for Li^- and Na^-
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摘要 Using a model potential to describe the interaction between the core and the valence electron, we perform hyperspherical calculations for electron affinity and geometry of the weakly bound Li^- and Na^- systems. In our calculation, channel functions are expanded in terms of B-splines. Using the special properties of B-splines, we make the knot distributions more precisely, characterizing the behaviour of channel functions. This improves the convergence greatly. Our results are in good agreement with the other theoretical and experimental values. Using a model potential to describe the interaction between the core and the valence electron, we perform hyperspherical calculations for electron affinity and geometry of the weakly bound Li^- and Na^- systems. In our calculation, channel functions are expanded in terms of B-splines. Using the special properties of B-splines, we make the knot distributions more precisely, characterizing the behaviour of channel functions. This improves the convergence greatly. Our results are in good agreement with the other theoretical and experimental values.
出处 《Chinese Physics Letters》 SCIE CAS CSCD 2007年第12期3392-3395,共4页 中国物理快报(英文版)
基金 Supported by the National Natural Science Foundation of China under Grant Nos 10374119 and 10674154.
关键词 THERMOELECTRIC half-Heusler compounds thermal conductivity thermoelectric, half-Heusler compounds, thermal conductivity
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