From b9894342fd841f8b067243090d6e7fdb645477be Mon Sep 17 00:00:00 2001 From: Jan Janssen Date: Sun, 14 Apr 2024 21:25:55 -0500 Subject: [PATCH 1/5] Update requirements.txt --- requirements.txt | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/requirements.txt b/requirements.txt index f88a3e5..5995b5b 100644 --- a/requirements.txt +++ b/requirements.txt @@ -1,3 +1,3 @@ nglview==3.1.2 pyiron==0.5.2 -pyiron_atomistics==0.5.0 +pyiron_atomistics==0.5.1 From c10a41daf12c7b5db210bc30af0cc3d3e3be896d Mon Sep 17 00:00:00 2001 From: Jan Janssen Date: Sun, 14 Apr 2024 21:26:09 -0500 Subject: [PATCH 2/5] Update construct.yaml --- constructor/construct.yaml | 4 ++-- 1 file changed, 2 insertions(+), 2 deletions(-) diff --git a/constructor/construct.yaml b/constructor/construct.yaml index 0b16a2f..1d4628f 100644 --- a/constructor/construct.yaml +++ b/constructor/construct.yaml @@ -7,14 +7,14 @@ channels: - https://conda.anaconda.org/pyiron [win] specs: - - python =3.11 + - python =3.12 - conda - notebook - jupyterlab - nodejs - nglview =3.1.2 - pyiron =0.5.2 - - pyiron_atomistics =0.5.0 + - pyiron_atomistics =0.5.1 - sphinxdft =3.1 [linux] - lammps =2023.08.02 [linux|osx] - lammps =2018.03.16 [win] From 82af2eeeaba56a5d364bae454bae97bfeea061c0 Mon Sep 17 00:00:00 2001 From: Jan Janssen Date: Sun, 14 Apr 2024 21:27:12 -0500 Subject: [PATCH 3/5] Update deploy.yml --- .github/workflows/deploy.yml | 6 +++--- 1 file changed, 3 insertions(+), 3 deletions(-) diff --git a/.github/workflows/deploy.yml b/.github/workflows/deploy.yml index b6a2c9a..92d3c50 100644 --- a/.github/workflows/deploy.yml +++ b/.github/workflows/deploy.yml @@ -50,7 +50,7 @@ jobs: - uses: conda-incubator/setup-miniconda@v2 with: auto-update-conda: true - python-version: "3.11" + python-version: "3.12" - name: Load Release URL File from release job uses: actions/download-artifact@v1 with: @@ -99,7 +99,7 @@ jobs: - uses: conda-incubator/setup-miniconda@v2 with: auto-update-conda: true - python-version: "3.11" + python-version: "3.12" - name: Load Release URL File from release job uses: actions/download-artifact@v1 with: @@ -148,7 +148,7 @@ jobs: - uses: conda-incubator/setup-miniconda@v2 with: auto-update-conda: true - python-version: "3.11" + python-version: "3.12" - name: Load Release URL File from release job uses: actions/download-artifact@v1 with: From 34784952e55128ab83a03bf61e160ea8257aa69e Mon Sep 17 00:00:00 2001 From: Jan Janssen Date: Sun, 14 Apr 2024 21:27:25 -0500 Subject: [PATCH 4/5] Update test.yml --- .github/workflows/test.yml | 6 +++--- 1 file changed, 3 insertions(+), 3 deletions(-) diff --git a/.github/workflows/test.yml b/.github/workflows/test.yml index 1f515c2..5ab71b0 100644 --- a/.github/workflows/test.yml +++ b/.github/workflows/test.yml @@ -14,7 +14,7 @@ jobs: - uses: conda-incubator/setup-miniconda@v2 with: auto-update-conda: true - python-version: "3.11" + python-version: "3.12" - name: Build Constructor shell: bash -l {0} run: | @@ -31,7 +31,7 @@ jobs: - uses: conda-incubator/setup-miniconda@v2 with: auto-update-conda: true - python-version: "3.11" + python-version: "3.12" - name: Build Constructor shell: bash -l {0} run: | @@ -48,7 +48,7 @@ jobs: - uses: conda-incubator/setup-miniconda@v2 with: auto-update-conda: true - python-version: "3.11" + python-version: "3.12" - name: Build Constructor shell: bash -l {0} run: | From 6a2921c389bc9417138d0adf506ed65c549ac7b0 Mon Sep 17 00:00:00 2001 From: Jan Janssen Date: Sun, 14 Apr 2024 21:38:27 -0500 Subject: [PATCH 5/5] Update construct.yaml --- constructor/construct.yaml | 2 +- 1 file changed, 1 insertion(+), 1 deletion(-) diff --git a/constructor/construct.yaml b/constructor/construct.yaml index 1d4628f..fb511b7 100644 --- a/constructor/construct.yaml +++ b/constructor/construct.yaml @@ -16,7 +16,7 @@ specs: - pyiron =0.5.2 - pyiron_atomistics =0.5.1 - sphinxdft =3.1 [linux] - - lammps =2023.08.02 [linux|osx] + - lammps =2024.02.07=*_openmpi_* [linux|osx] - lammps =2018.03.16 [win] post_install: post_build_win.bat [win]