avoid segfault in msm/dielectric

2024-10-10 05:19:32 -04:00
parent e6c9353ccf
commit 2935c17f78
1 changed files with 2 additions and 0 deletions
--- a/src/DIELECTRIC/msm_dielectric.cpp
+++ b/src/DIELECTRIC/msm_dielectric.cpp
@ -113,9 +113,11 @@ void MSMDielectric::compute(int eflag, int vflag)
  if (atom->nmax > nmax) {
    memory->destroy(part2grid);
    memory->destroy(efield);
+    memory->destroy(phi);
    nmax = atom->nmax;
    memory->create(part2grid,nmax,3,"msm:part2grid");
    memory->create(efield,nmax,3,"msm:efield");
+    memory->create(phi,nmax,"msm:phi");
  }

  // find grid points for all my particles