[ase-users] get energy from .traj

[Niels Theis Bendtsen]

Hi users

I have been so careless as to not save a logfile and the txt file is a mess.

Is it possible to extract the potential energy from a .traj file I mean it saves the energy so it should be rather straightforward.

However I have come up empy so far so now I ask you users.

Sincerely
Niels Theis Bendtsen
Ph.d.-studerende
FYS-CAMD
DTU Fysik
Bygning 307
2800 Kgs. Lyngby
Direkte telefon 45253177
ntben at fysik.dtu.dk
www.fysik.dtu.dk