mirror of https://github.com/lammps/lammps.git
git-svn-id: svn://svn.icms.temple.edu/lammps-ro/trunk@832 f3b2605a-c512-4ea7-a41b-209d697bcdaa
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@ -15,11 +15,11 @@
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Contributing author (triclinic) : Pieter in 't Veld (SNL)
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------------------------------------------------------------------------- */
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#include "mpi.h"
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#include "math.h"
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#include "string.h"
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#include "stdio.h"
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#include "stdlib.h"
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#include "mpi.h"
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#include "comm.h"
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#include "atom.h"
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#include "atom_vec.h"
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@ -14,8 +14,8 @@
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#ifndef LAMMPS_H
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#define LAMMPS_H
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#include "stdio.h"
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#include "mpi.h"
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#include "stdio.h"
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namespace LAMMPS_NS {
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@ -25,6 +25,7 @@ class Thermo : protected Pointers {
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public:
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char *style;
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int peflag;
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int normflag; // 0 if do not normalize by atoms, 1 if normalize
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double potential_energy;
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Thermo(class LAMMPS *, int, char **);
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@ -49,7 +50,6 @@ class Thermo : protected Pointers {
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char *format_int_user,*format_float_user;
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char **format,**format_user;
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int normflag; // 0 if do not normalize by atoms, 1 if normalize
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int normvalue; // use this for normflag unless natoms = 0
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int normuserflag; // 0 if user has not set, 1 if has
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int normuser;
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