All calculations were carried out using CASTEP software package, based on  pseudopotentials. Whereas the all electron potentials give comparatively better results  than the pseudopotentials to determine physical properties. Why did they not use all  electron potential based code?
我采用的是赝势法，这是审稿人的问题。谁来帮我最好用英语回答一下啊！谢谢啦！说出赝势的好处啊？ 返回小木虫查看更多