Pseudopotential相关论文
应用Pseudopotential(PP)和Projector augmented-wave(PAW)方法分别计算Fe,Co,Ni的bcc,fcc和hcp三种晶体结构时的晶格常数,原子磁......
为探究吕家坨井田地质构造格局,根据钻孔勘探资料,采用分形理论和趋势面分析方法,研究了井田7......
A well-known pseudopotential is used to investigate the superconducting state parameters (SSP), viz., electron-phonon co......
Detailed theoretical investigations into asphericity in the Fermi surface (FS) and Fermi energy (FE) ofNa1_xKx, Na1_xRbx......
A well-established pseodopotential is used to study the structure of some 4f rare earth liquid metals (Ce,Pr, Eu, Gd, Tb......
Different classes of first-principle pseudopotentials are compared and various schemes for pseudo-potential generation b......
采用基于密度泛函理论的第一性原理方法，应用两种赝势（US—PP和PAW）对纤锌矿结构ZnO晶体结构参数进行研究，计算发现两种赝势的计算结果......
考虑赝势近似下，驻波型激光脉冲和强激光场作用于Paul阱中的单离子系统产生的规则与混沌运动，应用积分法得到了系统的精确解，通过数值......
