From 74aec89d65e5dd61cc282f530d43365ba2c7fd36 Mon Sep 17 00:00:00 2001 From: Janosh Riebesell Date: Wed, 5 Jun 2024 13:24:35 -0400 Subject: [PATCH] unpin chgnet==0.3.5, now allow >=0.3.8 --- setup.py | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/setup.py b/setup.py index 69f2166df92..ab9522d67e3 100644 --- a/setup.py +++ b/setup.py @@ -52,7 +52,7 @@ "tblite": ["tblite[ase]>=0.3.0; python_version<'3.12'"], "vis": ["vtk>=6.0.0"], "abinit": ["netcdf4>=1.6.5"], - "relaxation": ["matgl>=1.1.1", "chgnet==0.3.5"], + "relaxation": ["matgl>=1.1.1", "chgnet>=0.3.8"], "electronic_structure": ["fdint>=2.0.2"], "dev": [ "mypy>=1.10.0", @@ -79,7 +79,7 @@ # caused CI failure due to ModuleNotFoundError: No module named 'packaging' # "BoltzTraP2>=22.3.2; platform_system!='Windows'", "chemview>=0.6", - "chgnet==0.3.5", + "chgnet>=0.3.8", "f90nml>=1.1.2", "galore>=0.6.1", "h5py>=3.11.0",