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Dear SIESTA users,
I have noticed that total energy in outputfile (e.g. siesta.out) is
measured in eV. In file siesta.MDE the total energy in each step also measured
in eV. But values is different (in 13.605). I suggest that in the file
siesta.MDE the total energy is measured in Ry. Am I right?
Thanks,
Sergey
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- [SIESTA-L] Unit of Energy in output files Sergey Lisenkov
- [SIESTA-L] Error in matel.f Marcos Verissimo Alves
- Re: [SIESTA-L] Error in matel.f Jose M. Soler

