in this log file from lammps, i try to calculate the
enthalpy obtained with Thermo_style with equation:
enthalpy= pe + press* vol (from thermo_style doc).
when i calculate this, i don't obtain the same and i
don't know exactly becouse, press and vol in the
thermo style custom are modified for something.
in the log file attach.
but press/n_atoms *vol not is equal to 2415.3065.
whats i don't see?
thank you for all.
log.lammps (4.8 KB)