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moved NUPDOWN from int_keys to float_keys (#4182)
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benjaminchen22 authored Nov 18, 2024
1 parent 225d43f commit 11295ba
Showing 1 changed file with 1 addition and 1 deletion.
2 changes: 1 addition & 1 deletion src/pymatgen/io/vasp/inputs.py
Original file line number Diff line number Diff line change
Expand Up @@ -970,6 +970,7 @@ def proc_val(key: str, val: str) -> list | bool | float | int | str:
"PARAM1",
"PARAM2",
"ENCUT",
"NUPDOWN",
)
int_keys = (
"NSW",
Expand All @@ -987,7 +988,6 @@ def proc_val(key: str, val: str) -> list | bool | float | int | str:
"LMAXMIX",
"NSIM",
"NKRED",
"NUPDOWN",
"ISPIND",
"LDAUTYPE",
"IVDW",
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