From 724f676b9dd9887f481fc09c3d99ff517b4c5a72 Mon Sep 17 00:00:00 2001 From: Jan Janssen Date: Mon, 22 Jan 2024 09:10:58 +0100 Subject: [PATCH 1/6] Update pyproject.toml --- pyproject.toml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/pyproject.toml b/pyproject.toml index 75f22ad9..9ff1b4d6 100644 --- a/pyproject.toml +++ b/pyproject.toml @@ -27,7 +27,7 @@ classifiers = [ dependencies = [ "ase==3.22.1", "numpy==1.26.3", - "scipy==1.11.4", + "scipy==1.12.0", "spglib==2.2.0", ] dynamic = ["version"] From 33bef5882f4016a8ec41defa4ee336da6ff36367 Mon Sep 17 00:00:00 2001 From: Jan Janssen Date: Mon, 22 Jan 2024 09:11:22 +0100 Subject: [PATCH 2/6] Update environment-docs.yml --- .ci_support/environment-docs.yml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/.ci_support/environment-docs.yml b/.ci_support/environment-docs.yml index 874e84de..9c5cf29f 100644 --- a/.ci_support/environment-docs.yml +++ b/.ci_support/environment-docs.yml @@ -8,7 +8,7 @@ dependencies: - ase =3.22.1 - coverage - numpy =1.26.3 - - scipy =1.11.4 + - scipy =1.12.0 - spglib =2.2.0 - phonopy =2.21.0 - structuretoolkit =0.0.17 From f846130c3a1a582f27d63dc3c3d2535f0a34ef12 Mon Sep 17 00:00:00 2001 From: Jan Janssen Date: Mon, 22 Jan 2024 09:11:54 +0100 Subject: [PATCH 3/6] Update environment.yml --- .ci_support/environment.yml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/.ci_support/environment.yml b/.ci_support/environment.yml index cd4d9131..0bb8bac0 100644 --- a/.ci_support/environment.yml +++ b/.ci_support/environment.yml @@ -4,7 +4,7 @@ dependencies: - ase =3.22.1 - coverage - numpy =1.26.3 -- scipy =1.11.4 +- scipy =1.12.0 - spglib =2.2.0 - phonopy =2.21.0 - structuretoolkit =0.0.17 From 83942e46121a5854b386e7ee1525a59394abe3aa Mon Sep 17 00:00:00 2001 From: Jan Janssen Date: Mon, 22 Jan 2024 09:16:04 +0100 Subject: [PATCH 4/6] Update environment-docs.yml --- .ci_support/environment-docs.yml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/.ci_support/environment-docs.yml b/.ci_support/environment-docs.yml index 9c5cf29f..7cacabeb 100644 --- a/.ci_support/environment-docs.yml +++ b/.ci_support/environment-docs.yml @@ -11,7 +11,7 @@ dependencies: - scipy =1.12.0 - spglib =2.2.0 - phonopy =2.21.0 - - structuretoolkit =0.0.17 + - structuretoolkit =0.0.18 - seekpath =2.1.0 - lammps =2023.08.02 - pandas =2.2.0 From 1182ee5356a3e143d90043e7aa9063302c9e6f01 Mon Sep 17 00:00:00 2001 From: Jan Janssen Date: Mon, 22 Jan 2024 09:16:15 +0100 Subject: [PATCH 5/6] Update environment.yml --- .ci_support/environment.yml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/.ci_support/environment.yml b/.ci_support/environment.yml index 0bb8bac0..fb24fbec 100644 --- a/.ci_support/environment.yml +++ b/.ci_support/environment.yml @@ -7,5 +7,5 @@ dependencies: - scipy =1.12.0 - spglib =2.2.0 - phonopy =2.21.0 -- structuretoolkit =0.0.17 +- structuretoolkit =0.0.18 - seekpath =2.1.0 From c6d011654580cd8973103083e2dd2274203aedc7 Mon Sep 17 00:00:00 2001 From: Jan Janssen Date: Mon, 22 Jan 2024 09:16:38 +0100 Subject: [PATCH 6/6] Update pyproject.toml --- pyproject.toml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/pyproject.toml b/pyproject.toml index 9ff1b4d6..1107fdcd 100644 --- a/pyproject.toml +++ b/pyproject.toml @@ -41,7 +41,7 @@ Repository = "https://github.com/pyiron/atomistics" phonopy = [ "phonopy==2.21.0", "seekpath==2.1.0", - "structuretoolkit==0.0.17", + "structuretoolkit==0.0.18", ] gpaw = [ "gpaw==24.1.0",