[gmx-users] g_potential output

Andre Farias de Moura andre at qt.dq.ufscar.br
Wed Nov 17 17:00:51 CET 2004


Dear gmx-users,

I just noticed that g_potential gives the wrong
units in the field.xvg output file, V/nm where
it should be V/m. if you get the potential data
(in V, as a function of distance in nm) you'll
get a field that differs from the data in the
field.xvg file by a factor of 1.0e9!

has anybody noticed that before?

best regards,

andre'

/-/-/-/-/-/-/-/-/-/-/-/-/-/-/-/-/-/

    Dr. Andre' Farias de Moura

/-/-/-/-/-/-/-/-/-/-/-/-/-/-/-/-/-/

  Laboratorio de Quimica Teorica
Universidade Federal de Sao Carlos
     Sao Carlos - SP - Brasil

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        Endereco Atual

    Grupo de Quimica Quantica
Instituto de Quimica de Sao Carlos
    Universidade de Sao Paulo
    Sao Carlos - SP - Brasil
    Telefone: 55-16-3373-8055

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