具有各种形式周期势场的一维晶体能带的计算-Various forms of one-dimensional periodic potential crystal band calculations

书中内容包括：数值计算基础，偏微分方程式的差分解法，有限单元法；用这些方法解有压管流，明渠流，闸孔出流，堰流，消能，地下水的渗流及平面势流等计算问题。利用了VB中的算法语言部分对水力学常见的计算题型编制成程序。(The contents of the book include: the basis of numerical calculation, the decomposition method of partial differential equation, finite element

这是气象上计算流函数势函数的相关程序，希望有帮助(Flow function potential function)

VASP计算POTCAR赝势文件 主要用于分子结构计算模拟(POTCAR of oxygen The projector augmented wave (PAW) potentials was employed and the energy cutoff of 400 eV was used. The generalized gradient approximation (GGA) with the Perdew-Burke-Ernzerhof (PBE) function was adopte