ICODE-ADC/lammps
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Tweaked one comment

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This commit is contained in:
Aidan Thompson
2022-02-19 20:55:37 -07:00
parent 407df3127b
commit bc8d1e0f84
1 changed files with 4 additions and 2 deletions
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6
src/EXTRA-COMPUTE/compute_born_matrix.cpp
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@ -592,9 +592,11 @@ void ComputeBornMatrix::update_virial()
{ {
int eflag = 0; int eflag = 0;
// NOTE: this may affect stress/atom output, untested // this may not be completely general
// but it works for lj/cut and sw pair styles
// and compute stress/atom output is unaffected
int vflag = VIRIAL_PAIR; // Need to generalize this int vflag = VIRIAL_PAIR;
if (force->pair) force->pair->compute(eflag, vflag); if (force->pair) force->pair->compute(eflag, vflag);