LOCAL DENSITY FUNCTIONAL FOR KINETIC-ENERGY

被引:8
作者
HUNTINGTON, HB
机构
[1] Physics Department, Rensselaer Polytechnic Institute, Troy
来源
PHYSICAL REVIEW B | 1979年 / 20卷 / 08期
关键词
D O I
10.1103/PhysRevB.20.3165
中图分类号
T [工业技术];
学科分类号
08 ;
摘要
One seeks a local functional of the electron density to give approximately the kinetic energy. The application is primarily to an otherwise uniform electron gas in the neighborhood of a defect or metal surface. The approach is through consideration of the charge distributions at a square potential step; V0EF for a free surface and V0<EF at an interface between two metals. The fit to the charge-density distributions for a linear potential appears equally satisfactory. © 1979 The American Physical Society.
引用
收藏
页码:3165 / 3171
页数:7
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