The band structure and pressure(at T=0)as functions of compression V_(0)/V have been calculated for copper in terms of Augmented Spherical Wave(ASW)method.The calculation covered the V_(0)/V values from 1 up to 10.The...The band structure and pressure(at T=0)as functions of compression V_(0)/V have been calculated for copper in terms of Augmented Spherical Wave(ASW)method.The calculation covered the V_(0)/V values from 1 up to 10.The results illustrate that ASW method is at least as accurate as other standard methods in this field.展开更多
文摘The band structure and pressure(at T=0)as functions of compression V_(0)/V have been calculated for copper in terms of Augmented Spherical Wave(ASW)method.The calculation covered the V_(0)/V values from 1 up to 10.The results illustrate that ASW method is at least as accurate as other standard methods in this field.
