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fix: delete breakpoint
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ZLI-afk committed Dec 18, 2023
1 parent f9ea6e5 commit 58427cf
Showing 1 changed file with 2 additions and 2 deletions.
4 changes: 2 additions & 2 deletions apex/core/property/Interstitial.py
Original file line number Diff line number Diff line change
Expand Up @@ -186,10 +186,10 @@ def make_confs(self, path_to_work, path_to_equi, refine=False):

if self.inter_param["type"] == "abacus":
ss = abacus_utils.stru2Structure(equi_contcar)
orig_ss = abacus_utils.stru2Structure(orig_poscar)
# orig_ss = abacus_utils.stru2Structure(orig_poscar)
else:
ss = Structure.from_file(equi_contcar)
orig_ss = Structure.from_file(orig_poscar)
# orig_ss = Structure.from_file(orig_poscar)

# get structure type
os.chdir(self.path_to_work)
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