diff --git a/.ci_support/environment.yml b/.ci_support/environment.yml index 88737e4f3..83c9ab9bc 100644 --- a/.ci_support/environment.yml +++ b/.ci_support/environment.yml @@ -12,7 +12,7 @@ dependencies: - numpy =2.3.4 - phonopy =2.43.6 - plotly =6.3.1 -- pymatgen =2025.6.14 +- pymatgen =2025.10.7 - pyscal3 =3.3.0 - scikit-learn =1.7.2 - scipy =1.16.3 diff --git a/pyproject.toml b/pyproject.toml index a6743a11b..9a3937b6e 100644 --- a/pyproject.toml +++ b/pyproject.toml @@ -39,7 +39,7 @@ Repository = "https://github.com/pyiron/structuretoolkit" dscribe = ["dscribe==2.1.2"] grainboundary = [ "aimsgb==1.1.1", - "pymatgen==2025.6.14", + "pymatgen==2025.10.7", ] pyscal = ["pyscal3==3.3.0"] nglview = ["nglview==3.1.4"] @@ -49,7 +49,7 @@ clusters = ["scikit-learn==1.7.2"] symmetry = ["spglib==2.6.0"] surface = [ "spglib==2.6.0", - "pymatgen==2025.6.14", + "pymatgen==2025.10.7", ] phonopy = [ "phonopy==2.43.6",