From 770c0ca54001c9c9ec63638e752615d2be483b00 Mon Sep 17 00:00:00 2001 From: Eric Prestat Date: Tue, 16 May 2023 09:18:11 +0100 Subject: [PATCH] Add pymatgen --- .github/workflows/release.yml | 2 +- conda_distribution/construct.yaml | 1 + 2 files changed, 2 insertions(+), 1 deletion(-) diff --git a/.github/workflows/release.yml b/.github/workflows/release.yml index 8d2a109..7054262 100644 --- a/.github/workflows/release.yml +++ b/.github/workflows/release.yml @@ -294,7 +294,7 @@ jobs: WP_EXE: winpython.exe WP_DIR_NAME: WPy64-31090 TEST_DEPS: pytest pytest-qt pytest-xdist pytest-rerunfailures - LIB_TO_INSTALL: abtem ase atomap graphviz hdf5plugin hyperspy[all] hyperspyui kikuchipy lumispy matplotlib-scalebar nglview py4dstem particlespy pystackreg python-rapidjson pyxem scanning_drift_corr start_jupyter_cm + LIB_TO_INSTALL: abtem ase atomap graphviz hdf5plugin hyperspy[all] hyperspyui kikuchipy lumispy matplotlib-scalebar nglview particlespy py4dstem pymatgen pystackreg python-rapidjson pyxem scanning_drift_corr start_jupyter_cm LIB_TO_TEST: lumispy pyxem kikuchipy LIB_TO_TEST_SKIP: '' diff --git a/conda_distribution/construct.yaml b/conda_distribution/construct.yaml index d7f9781..05b324b 100644 --- a/conda_distribution/construct.yaml +++ b/conda_distribution/construct.yaml @@ -40,6 +40,7 @@ specs: - ovito =3.7 # [not win] - particlespy - py4dstem + - pymatgen - pystackreg - python 3.10* - python-graphviz