From 02ff2cc32e618a11ceab26aecfe0a5196abdb1af Mon Sep 17 00:00:00 2001 From: Hrushikesh Sahasrabuddhe Date: Mon, 29 Jul 2024 12:25:39 -0700 Subject: [PATCH] reduced the user_kpoints_settings -- "reciprocal_density" to 100 --- src/atomate2/vasp/flows/hiphive.py | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/src/atomate2/vasp/flows/hiphive.py b/src/atomate2/vasp/flows/hiphive.py index e2e48f0f70..61a2d9508f 100644 --- a/src/atomate2/vasp/flows/hiphive.py +++ b/src/atomate2/vasp/flows/hiphive.py @@ -99,7 +99,7 @@ class HiphiveMaker(BaseHiphiveMaker): phonon_displacement_maker: BaseVaspMaker | None = field( default_factory=lambda:PhononDisplacementMaker( input_set_generator = StaticSetGenerator( - user_kpoints_settings={"reciprocal_density": 500}, + user_kpoints_settings={"reciprocal_density": 100}, user_incar_settings={ "ADDGRID": True, "ALGO": "Normal",