弱弱的问一句,lammps中 read_data create_atom 能一起用吗? 有没有人这么用过 ...
IN文件如下:# 3d TIP4P water model units real variable T equal 298.16 variable P equal...
compute ${vy} all reduce ave c_atomprops[2] variable a string c_${omeg} variable b string c_${vy}" and also it is possible to give a string to the next: "variable allresult string ${a}" but why is it not possible to create a string out of two or more strings? "variable al...
Resetting per-atom state of Fix contacthistory Style contacthistory from restart file info ERROR: Please increase the number of atom types in the 'create_box' command to match the number of atom types you use in the simulation (../properties.cpp:122) --- Primary job terminated normally, bu...
IN文件如下:# 3d TIP4P water model units real variable T equal 298.16 variable P equal...
应该先设定盒子,然后再在盒子里加region,在region里加原子。参考命令:region boxx block 0 5 0 5...
ERROR: Please increase the number of atom types in the 'create_box' command to match the number of atom types you use in the simulation (../properties.cpp:122) Primary job terminated normally, but 1 process returned a non-zero exit code.. Per user-direction, the job ...
弱弱的问一句,lammps中 read_data create_atom 能一起用吗? 有没有人这么用过 ...
IN文件如下:# 3d TIP4P water model units real variable T equal 298.16 variable P equal...