In which cpp file can I find the code for creating ghost atoms and their indexes? As well as how are the numbers nghost, nall determined?
Thanks!
Xiang Gu
In which cpp file can I find the code for creating ghost atoms and their indexes? As well as how are the numbers nghost, nall determined?
Thanks!
Xiang Gu
Look in communicate.cpp and atom.cpp and atom_vec_*.cpp.
Steve