Commit c4771291 authored by Steven J. Plimpton's avatar Steven J. Plimpton
Browse files

real <-> metal unit conversion factors

parent d8b087ae

src/MESSAGE/fix_client_md.cpp

+3 −4
Original line number Diff line number Diff line
@@ -64,13 +64,12 @@ FixClientMD::FixClientMD(LAMMPS *lmp, int narg, char **arg) : 


  // unit conversion factors for REAL

  // otherwise not needed

  // message received in METAL units, convert to local REAL units



  fconvert = econvert = vconvert = 1.0;

  if (units == REAL) {

    // NOTE: still need to set these

    fconvert = 1.0;

    econvert = 1.0;

    vconvert = 1.0;

    fconvert = econvert = 23.06035;

    vconvert = 0.986923;

  }

}

src/MESSAGE/server_md.cpp

+3 −4
Original line number Diff line number Diff line
@@ -55,13 +55,12 @@ ServerMD::ServerMD(LAMMPS *lmp) : Pointers(lmp) 


  // unit conversion factors for REAL

  // otherwise not needed

  // local computation in REAL units, send message in METAL units



  fconvert = econvert = vconvert = 1.0;

  if (units == REAL) {

    // NOTE: still need to set these

    fconvert = 1.0;

    econvert = 1.0;

    vconvert = 1.0;

    fconvert = econvert = 1.0 / 23.06035;

    vconvert = 1.0 / 0.986923;

  }



  fcopy = NULL;

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