From d73e52f7eb8b3bc65a6c3fae53429cddc7f8fd6f Mon Sep 17 00:00:00 2001 From: Steven Zeltmann Date: Fri, 8 Dec 2023 17:01:44 -0500 Subject: [PATCH] prevent pymatgen from messing with CIFs --- py4DSTEM/process/diffraction/crystal.py | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/py4DSTEM/process/diffraction/crystal.py b/py4DSTEM/process/diffraction/crystal.py index fb2911992..c3a7519d0 100644 --- a/py4DSTEM/process/diffraction/crystal.py +++ b/py4DSTEM/process/diffraction/crystal.py @@ -273,7 +273,7 @@ def from_CIF(CIF, conventional_standard_structure=True): parser = CifParser(CIF) - structure = parser.get_structures()[0] + structure = parser.get_structures(False)[0] return Crystal.from_pymatgen_structure( structure, conventional_standard_structure=conventional_standard_structure