From 48c6282a7182f0f1b8ebf3fc4db1d316e17a3ae9 Mon Sep 17 00:00:00 2001 From: "dependabot[bot]" <49699333+dependabot[bot]@users.noreply.github.com> Date: Mon, 13 Oct 2025 03:01:45 +0000 Subject: [PATCH 1/7] Bump mpi4py from 4.1.0 to 4.1.1 Bumps [mpi4py](https://github.com/mpi4py/mpi4py) from 4.1.0 to 4.1.1. - [Release notes](https://github.com/mpi4py/mpi4py/releases) - [Changelog](https://github.com/mpi4py/mpi4py/blob/master/CHANGES.rst) - [Commits](https://github.com/mpi4py/mpi4py/compare/4.1.0...4.1.1) --- updated-dependencies: - dependency-name: mpi4py dependency-version: 4.1.1 dependency-type: direct:production update-type: version-update:semver-patch ... Signed-off-by: dependabot[bot] --- pyproject.toml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/pyproject.toml b/pyproject.toml index 6641011..a696bdc 100644 --- a/pyproject.toml +++ b/pyproject.toml @@ -24,7 +24,7 @@ classifiers = [ "Programming Language :: Python :: 3.12", ] dependencies = [ - "mpi4py==4.1.0", + "mpi4py==4.1.1", "executorlib==1.7.1", "numpy==2.3.3", ] From 1029de90e2a98af1e50ef3136bf05be195e5fcef Mon Sep 17 00:00:00 2001 From: "github-actions[bot]" <41898282+github-actions[bot]@users.noreply.github.com> Date: Mon, 13 Oct 2025 03:01:55 +0000 Subject: [PATCH 2/7] [dependabot skip] Update environment --- .ci_support/environment-mpich.yml | 2 +- .ci_support/environment-openmpi.yml | 2 +- binder/environment.yml | 2 +- 3 files changed, 3 insertions(+), 3 deletions(-) diff --git a/.ci_support/environment-mpich.yml b/.ci_support/environment-mpich.yml index 6f86e09..e442cd1 100644 --- a/.ci_support/environment-mpich.yml +++ b/.ci_support/environment-mpich.yml @@ -5,7 +5,7 @@ dependencies: - lammps =2024.08.29=*_mpi_mpich_* - mpich =4.3.1 - numpy =2.3.3 -- mpi4py =4.1.0 +- mpi4py =4.1.1 - executorlib =1.7.1 - ase =3.26.0 - scipy =1.16.2 diff --git a/.ci_support/environment-openmpi.yml b/.ci_support/environment-openmpi.yml index b469d81..e0dead7 100644 --- a/.ci_support/environment-openmpi.yml +++ b/.ci_support/environment-openmpi.yml @@ -5,7 +5,7 @@ dependencies: - lammps =2024.08.29=*_mpi_openmpi_* - openmpi =5.0.8 - numpy =2.3.3 -- mpi4py =4.1.0 +- mpi4py =4.1.1 - executorlib =1.7.1 - ase =3.26.0 - scipy =1.16.2 diff --git a/binder/environment.yml b/binder/environment.yml index ecf3078..a274c7c 100644 --- a/binder/environment.yml +++ b/binder/environment.yml @@ -6,7 +6,7 @@ dependencies: - hatch-vcs - numpy =2.3.3 - lammps =2024.08.29=*_mpi_openmpi_* -- mpi4py =4.1.0 +- mpi4py =4.1.1 - executorlib =1.7.1 - ase =3.26.0 - scipy =1.16.2 From e618351292d1e845389760454174988c78d6820d Mon Sep 17 00:00:00 2001 From: Jan Janssen Date: Mon, 20 Oct 2025 17:41:58 +0200 Subject: [PATCH 3/7] Update environment-mpich.yml --- .ci_support/environment-mpich.yml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/.ci_support/environment-mpich.yml b/.ci_support/environment-mpich.yml index e442cd1..424aca0 100644 --- a/.ci_support/environment-mpich.yml +++ b/.ci_support/environment-mpich.yml @@ -6,7 +6,7 @@ dependencies: - mpich =4.3.1 - numpy =2.3.3 - mpi4py =4.1.1 -- executorlib =1.7.1 +- executorlib =1.7.2 - ase =3.26.0 - scipy =1.16.2 - hatchling From 21149f7fd59320901d893b363731ff77af78614f Mon Sep 17 00:00:00 2001 From: Jan Janssen Date: Mon, 20 Oct 2025 17:42:08 +0200 Subject: [PATCH 4/7] Update environment-openmpi.yml --- .ci_support/environment-openmpi.yml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/.ci_support/environment-openmpi.yml b/.ci_support/environment-openmpi.yml index e0dead7..0712737 100644 --- a/.ci_support/environment-openmpi.yml +++ b/.ci_support/environment-openmpi.yml @@ -6,7 +6,7 @@ dependencies: - openmpi =5.0.8 - numpy =2.3.3 - mpi4py =4.1.1 -- executorlib =1.7.1 +- executorlib =1.7.2 - ase =3.26.0 - scipy =1.16.2 - hatchling From ecb243da0a8b8eead6a42c26dde505d0de1ac49a Mon Sep 17 00:00:00 2001 From: Jan Janssen Date: Mon, 20 Oct 2025 17:42:20 +0200 Subject: [PATCH 5/7] Update environment.yml --- binder/environment.yml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/binder/environment.yml b/binder/environment.yml index a274c7c..11e7f4e 100644 --- a/binder/environment.yml +++ b/binder/environment.yml @@ -7,6 +7,6 @@ dependencies: - numpy =2.3.3 - lammps =2024.08.29=*_mpi_openmpi_* - mpi4py =4.1.1 -- executorlib =1.7.1 +- executorlib =1.7.2 - ase =3.26.0 - scipy =1.16.2 From fd0b69af8ce919e8c19f77a23ab0d550eeef5ce6 Mon Sep 17 00:00:00 2001 From: Jan Janssen Date: Mon, 20 Oct 2025 17:42:38 +0200 Subject: [PATCH 6/7] Update pyproject.toml --- pyproject.toml | 3 ++- 1 file changed, 2 insertions(+), 1 deletion(-) diff --git a/pyproject.toml b/pyproject.toml index a696bdc..06fe4c0 100644 --- a/pyproject.toml +++ b/pyproject.toml @@ -22,10 +22,11 @@ classifiers = [ "Programming Language :: Python :: 3.10", "Programming Language :: Python :: 3.11", "Programming Language :: Python :: 3.12", + "Programming Language :: Python :: 3.13", ] dependencies = [ "mpi4py==4.1.1", - "executorlib==1.7.1", + "executorlib==1.7.2", "numpy==2.3.3", ] dynamic = ["version"] From 6f8d9613896dffd64400aee63397a847b49d29eb Mon Sep 17 00:00:00 2001 From: Jan Janssen Date: Mon, 20 Oct 2025 17:47:37 +0200 Subject: [PATCH 7/7] Update environment-mpich.yml --- .ci_support/environment-mpich.yml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/.ci_support/environment-mpich.yml b/.ci_support/environment-mpich.yml index 424aca0..ad8463a 100644 --- a/.ci_support/environment-mpich.yml +++ b/.ci_support/environment-mpich.yml @@ -3,7 +3,7 @@ channels: dependencies: - coverage - lammps =2024.08.29=*_mpi_mpich_* -- mpich =4.3.1 +- mpich =4.3.2 - numpy =2.3.3 - mpi4py =4.1.1 - executorlib =1.7.2