Daniel P. Luis Jimenez wrote:
Hello

i have a simulation of a box with 368 water  and 64 methanes molecules, and
i have a value of the total energy in kj/mol, my question is ,is this energy
the total energy in moles of all the system or per molecule of the system.
for your help tks

kJ/mol = kilojoules per mole

Total energy is just that, not some weird per-molecule thing, which isn't even well-defined for a heterogeneous system.

Mark
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