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phonopy-0.9.1.4.tar
- 在vasp软件里面计算声子的文件。声子计算主要用于计算晶格受到温度影响下的振动。-Calculated in software inside the phonon vasp file. Phonon calculations are mainly used to calculate the temperature under the influence of lattice vibrations.
phonopy-0.9.1.4.tar
- 在VASP中主要是用于晶格震动计算,得出声子谱(Lattice vibration calculation)
phonopy-1.11.12.31.tar
- 声子谱计算,计算晶体材料的声子谱,结合vasp第一原理的平面波赝势软件使用。(phonon calculating,Calculate the phonon spectrum of crystal materials, combined with vasp first principle pseudopotential plane wave software.)
phonopy-1.12.2.20.tar
- linux安装phonopy python numpy lxml matplotlib PyYAML(linux phonopy python numpy lxml matplotlib PyYAML)