Hii,
What will be the computational cost for simulating about 1 million atoms?
Depends heavily on system settings such as the forcefield (a kremer grest model has completely different computational cost than reaxff)
Στις Σάββατο, 26 Μαρτίου 2022, ο χρήστης Dar Javeed <[email protected]> έγραψε:
The only way to know is to run the input script of the section “EAM metallic solid benchmark” from https://www.lammps.org/bench.html
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HTH
Evangelos
Στις Σάββατο, 26 Μαρτίου 2022, ο χρήστης Dar Javeed <[email protected]> έγραψε: