Total Energy from GW
Posted: Tue Mar 12, 2013 2:13 am
Can anyone tell me how to get the total energy from a scGW calculation?
I can't find anything in the OUTCAR and the release notes list this feature as being experimental. I urgently need to correlate some total energies with structures.
I apologise is this has been answered here before but I could not find an answer.
I can't find anything in the OUTCAR and the release notes list this feature as being experimental. I urgently need to correlate some total energies with structures.
I apologise is this has been answered here before but I could not find an answer.