add phono3y into complete

hackingmaterials · Mar 11, 2024 · 93a422f · 93a422f
1 parent fa41428
commit 93a422f
Show file tree

Hide file tree

Showing 2 changed files with 1 addition and 1 deletion.
diff --git a/atomate/vasp/workflows/tests/test_adsorbate_workflow.py b/atomate/vasp/workflows/tests/test_adsorbate_workflow.py
@@ -16,7 +16,6 @@
     get_slab_trans_params,
     get_wf_slab,
 )
-from phono3py.phonon3.gruneisen import Gruneisen
 
 __author__ = "Kiran Mathew, Joseph Montoya"
 __email__ = "[email protected]"

diff --git a/setup.py b/setup.py
@@ -51,6 +51,7 @@
                 "matplotlib>=1.5.2",
                 "phonopy>=2.21.0",
                 "openbabel-wheel",
+                "phono3py",
                 "hiphive @ git+https://gitlab.com/jsyony37/hiphive.git@personal#egg=hiphive",
                 "f90nml==1.4.4",
                 "spglib>=2.2.0",