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LAMMPS入门教程(2)——从in文件建立讲分子动力学模拟流程
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Web7. Your problem comes from the line: fix 11 A print v_com "coords of center of mass" file cdm.dat. As per the documentation, the correct syntax is: fix ID group-ID print N string keyword value ... Where it will print every N timesteps. So you are asking LAMMPS to print the same message every v_com timesteps. And LAMMPS is respectfully telling ... WebAug 31, 2024 · LAMMPS错误提示. 1.出现using neigh_modify every 1 delay 0 check yes setting during minimization. 出现这两种情况的原因就是neigh_modify和minimize相互排 … Webneigh_modify every 2 delay 10 check yes page 100000 neigh_modify exclude type 2 3 neigh_modify exclude group frozen frozen check no neigh_modify exclude group … u of arizona women\u0027s basketball tickets