encode improper symmetries

This commit is contained in:
jrgissing
2023-03-09 22:04:08 -05:00
parent 41c5ba98ab
commit 53056f47ed
14 changed files with 63 additions and 5 deletions

View File

@ -30,6 +30,7 @@ Improper::Improper(LAMMPS *_lmp) : Pointers(_lmp)
{
energy = 0.0;
writedata = 0;
for (int i = 0; i < 4; i++) symmatoms[i] = 0;
allocated = 0;
suffix_flag = Suffix::NONE;