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changes to USER-MISC package

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Plimpton
2021-01-21 15:37:18 -07:00
parent 4397706654
commit 54e3ee74a2
9 changed files with 74 additions and 74 deletions
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2
src/USER-MISC/fix_npt_cauchy.cpp
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@ -61,6 +61,7 @@ FixNPTCauchy::FixNPTCauchy(LAMMPS *lmp, int narg, char **arg) :
if (narg < 4) error->all(FLERR,"Illegal fix npt/cauchy command");
dynamic_group_allow = 1;
ecouple_flag = 1;
time_integrate = 1;
scalar_flag = 1;
vector_flag = 1;
@ -686,7 +687,6 @@ int FixNPTCauchy::setmask()
int mask = 0;
mask |= INITIAL_INTEGRATE;
mask |= FINAL_INTEGRATE;
mask |= THERMO_ENERGY;
mask |= INITIAL_INTEGRATE_RESPA;
mask |= FINAL_INTEGRATE_RESPA;
if (pre_exchange_flag) mask |= PRE_EXCHANGE;