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plot dos
- 绘制第一性原理计算态密度图,读取数据点进行画图(First principles calculation of density of States was drawn, and data points were read for drawing)
清华DFT课件
- 学习第一性原理计算,学习使用VASP软件的使用(First principles calculation)
vasp硬核物理知识、固体物理教程
- VASP第一性原理计算的案例,通过编程以及VASP软件实现计算。(The first principle calculation case of VASP is realized by programming and VASP software.)
可复制的算例
- VASP经典案例学习,有助于快速入门第一性原理的计算(The first principle calculation case of VASP is realized by programming and VASP software.)