From fd2cda66bbb22ccfcb2db522a6e4866834074e77 Mon Sep 17 00:00:00 2001 From: Axel Kohlmeyer Date: Tue, 7 Mar 2023 20:18:41 -0500 Subject: [PATCH] handle the case when the bond style is recreated after a restart --- src/EXTRA-MOLECULE/bond_harmonic_restrain.cpp | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/src/EXTRA-MOLECULE/bond_harmonic_restrain.cpp b/src/EXTRA-MOLECULE/bond_harmonic_restrain.cpp index 76e7347ada..32e1226347 100644 --- a/src/EXTRA-MOLECULE/bond_harmonic_restrain.cpp +++ b/src/EXTRA-MOLECULE/bond_harmonic_restrain.cpp @@ -40,7 +40,7 @@ BondHarmonicRestrain::BondHarmonicRestrain(LAMMPS *_lmp) : Bond(_lmp), initial(n BondHarmonicRestrain::~BondHarmonicRestrain() { - modify->delete_fix("BOND_RESTRAIN"); + if (initial) modify->delete_fix("BOND_RESTRAIN"); if (allocated) { memory->destroy(setflag); memory->destroy(k);