daniel luis wrote:
Hello.
i would like to know, how is the total energy whe the external electric
field is
implemented in GMX, the field only interact with point charges?
The field interacts with point charges according to F = q E.
The field exerts work on the system and hence energy is not conserved
when there is a field.
See Angew. Chem. Intl. Ed. 47 pp. 1417-1420 (2008)
thanks for your help
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