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bpuchalabpuchala
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bump version 2.0.0
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Lines changed: 110 additions & 75 deletions

‎.github/workflows/build_wheels.yml‎

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@@ -8,8 +8,8 @@ on:
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jobs:
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build_wheels_linux_x86_64:
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name: Build x86_64 wheels on ubuntu-22.04
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runs-on: ubuntu-22.04
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name: Build x86_64 wheels on ubuntu-24.04
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runs-on: ubuntu-24.04
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steps:
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- uses: actions/checkout@v4
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- uses: actions/upload-artifact@v4
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with:
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name: dist_linux
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name: dist_linux_x86_64
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path: ./wheelhouse/*.whl
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build_wheels_linux_aarch64:
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name: Build aarch64 wheels on ubuntu-24.04
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runs-on: ubuntu-24.04-arm
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steps:
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- uses: actions/checkout@v4
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- name: Build wheels
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uses: pypa/cibuildwheel@v2.23.3
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env:
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CIBW_ARCHS_LINUX: aarch64
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- uses: actions/upload-artifact@v4
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with:
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name: dist_linux_aarch64
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path: ./wheelhouse/*.whl
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build_wheels_macos13_x86_64:
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name: dist_macos13_x86_64
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path: ./wheelhouse/*.whl
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build_wheels_macos14_arm64:
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name: Build arm64 wheels on macos-14
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runs-on: macos-14
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build_wheels_macos15_arm64:
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name: Build arm64 wheels on macos-15
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runs-on: macos-15
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steps:
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- uses: actions/checkout@v4
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- uses: actions/upload-artifact@v4
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with:
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name: dist_macos14_arm64
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name: dist_macos15_arm64
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path: ./wheelhouse/*.whl
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build_sdist:
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- uses: actions/checkout@v4
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- uses: actions/setup-python@v5
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with:
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python-version: '3.11'
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python-version: '3.13'
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- name: Set up requirements and configuration variables
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run: |
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sudo apt-get update
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sudo apt-get install build-essential cmake
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pip install --upgrade pip wheel build
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git submodule update --init --recursive
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- name: make
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shell: bash

‎.github/workflows/test-linux-build.yml‎

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@@ -21,7 +21,7 @@ jobs:
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- uses: actions/checkout@v4
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- uses: actions/setup-python@v5
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with:
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python-version: '3.11'
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python-version: '3.13'
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- name: Set up requirements & configuration variables
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run: |
@@ -36,31 +36,31 @@ jobs:
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uses: actions/cache/restore@v4
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with:
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path: CASMcode_global/dist
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key: ${{ runner.os }}-libcasm-global-v2-0-5
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key: ${{ runner.os }}-libcasm-global-v2-0-6
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### libcasm-xtal ###
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- name: restore libcasm-xtal cache
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id: cache-libcasm-xtal-restore
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uses: actions/cache/restore@v4
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with:
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path: CASMcode_crystallography/dist
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key: ${{ runner.os }}-libcasm-xtal-v2-0a12
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key: ${{ runner.os }}-libcasm-xtal-v2-0-0
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### libcasm-mapping ###
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- name: restore libcasm-mapping cache
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id: cache-libcasm-mapping-restore
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uses: actions/cache/restore@v4
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with:
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path: CASMcode_mapping/dist
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key: ${{ runner.os }}-libcasm-mapping-v2-0a4
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key: ${{ runner.os }}-libcasm-mapping-v2-0-0
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### libcasm-clexulator ###
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- name: restore libcasm-clexulator cache
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id: cache-libcasm-clexulator-restore
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uses: actions/cache/restore@v4
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with:
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path: CASMcode_clexulator/dist
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key: ${{ runner.os }}-libcasm-clexulator-v2-0a5
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key: ${{ runner.os }}-libcasm-clexulator-v2-0-0
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- name: Install CASM dependencies
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run: |

‎.github/workflows/test-linux-cxx-only.yml‎

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@@ -21,7 +21,7 @@ jobs:
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- uses: actions/checkout@v4
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- uses: actions/setup-python@v5
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with:
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python-version: '3.11'
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python-version: '3.13'
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- name: Set up requirements & configuration variables
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run: |
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uses: actions/cache/restore@v4
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with:
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path: CASMcode_global/dist
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key: ${{ runner.os }}-libcasm-global-v2-0-5
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key: ${{ runner.os }}-libcasm-global-v2-0-6
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### libcasm-xtal ###
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- name: restore libcasm-xtal cache
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id: cache-libcasm-xtal-restore
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uses: actions/cache/restore@v4
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with:
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path: CASMcode_crystallography/dist
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key: ${{ runner.os }}-libcasm-xtal-v2-0a12
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key: ${{ runner.os }}-libcasm-xtal-v2-0-0
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### libcasm-clexulator ###
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- name: restore libcasm-clexulator cache
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id: cache-libcasm-clexulator-restore
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uses: actions/cache/restore@v4
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with:
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path: CASMcode_clexulator/dist
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key: ${{ runner.os }}-libcasm-clexulator-v2-0a5
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key: ${{ runner.os }}-libcasm-clexulator-v2-0-0
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- name: Install CASM dependencies
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run: |

‎.github/workflows/test-linux-dependencies.yml‎

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steps:
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- uses: actions/setup-python@v5
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with:
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python-version: '3.11'
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python-version: '3.13'
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- name: Set up requirements & configuration variables
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run: |
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uses: actions/cache/restore@v4
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with:
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path: CASMcode_global/dist
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key: ${{ runner.os }}-libcasm-global-v2-0-5
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key: ${{ runner.os }}-libcasm-global-v2-0-6
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- name: checkout libcasm-global
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if: steps.cache-libcasm-global-restore.outputs.cache-hit != 'true'
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uses: actions/checkout@v4
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with:
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repository: prisms-center/CASMcode_global
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path: CASMcode_global
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ref: v2.0.5
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ref: v2.0.6
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- name: make global
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if: steps.cache-libcasm-global-restore.outputs.cache-hit != 'true'
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uses: actions/cache/restore@v4
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with:
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path: CASMcode_crystallography/dist
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key: ${{ runner.os }}-libcasm-xtal-v2-0a12
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key: ${{ runner.os }}-libcasm-xtal-v2-0-0
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- name: checkout libcasm-xtal
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if: steps.cache-libcasm-xtal-restore.outputs.cache-hit != 'true'
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uses: actions/checkout@v4
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with:
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repository: prisms-center/CASMcode_crystallography
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path: CASMcode_crystallography
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ref: v2.0a12
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ref: v2.0.0
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- name: make xtal
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if: steps.cache-libcasm-xtal-restore.outputs.cache-hit != 'true'
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uses: actions/cache/restore@v4
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with:
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path: CASMcode_mapping/dist
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key: ${{ runner.os }}-libcasm-mapping-v2-0a4
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key: ${{ runner.os }}-libcasm-mapping-v2-0-0
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- name: checkout libcasm-mapping
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if: steps.cache-libcasm-mapping-restore.outputs.cache-hit != 'true'
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uses: actions/checkout@v4
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with:
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repository: prisms-center/CASMcode_mapping
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path: CASMcode_mapping
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ref: v2.0a4
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ref: v2.0.0
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- name: make mapping
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if: steps.cache-libcasm-mapping-restore.outputs.cache-hit != 'true'
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uses: actions/cache/restore@v4
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with:
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path: CASMcode_clexulator/dist
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key: ${{ runner.os }}-libcasm-clexulator-v2-0a5
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key: ${{ runner.os }}-libcasm-clexulator-v2-0-0
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- name: checkout libcasm-clexulator
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if: steps.cache-libcasm-clexulator-restore.outputs.cache-hit != 'true'
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uses: actions/checkout@v4
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with:
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repository: prisms-center/CASMcode_clexulator
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path: CASMcode_clexulator
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ref: v2.0a5
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ref: v2.0.0
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- name: make clexulator
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if: steps.cache-libcasm-clexulator-restore.outputs.cache-hit != 'true'

‎.github/workflows/test-linux.yml‎

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- uses: actions/checkout@v4
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- uses: actions/setup-python@v5
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with:
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python-version: '3.11'
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python-version: '3.13'
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- name: Set up requirements & configuration variables
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run: |
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uses: actions/cache/restore@v4
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with:
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path: CASMcode_global/dist
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key: ${{ runner.os }}-libcasm-global-v2-0-5
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key: ${{ runner.os }}-libcasm-global-v2-0-6
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### libcasm-xtal ###
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- name: restore libcasm-xtal cache
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id: cache-libcasm-xtal-restore
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uses: actions/cache/restore@v4
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with:
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path: CASMcode_crystallography/dist
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key: ${{ runner.os }}-libcasm-xtal-v2-0a12
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key: ${{ runner.os }}-libcasm-xtal-v2-0-0
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### libcasm-mapping ###
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- name: restore libcasm-mapping cache
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id: cache-libcasm-mapping-restore
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uses: actions/cache/restore@v4
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with:
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path: CASMcode_mapping/dist
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key: ${{ runner.os }}-libcasm-mapping-v2-0a4
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key: ${{ runner.os }}-libcasm-mapping-v2-0-0
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### libcasm-clexulator ###
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- name: restore libcasm-clexulator cache
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id: cache-libcasm-clexulator-restore
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uses: actions/cache/restore@v4
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with:
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path: CASMcode_clexulator/dist
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key: ${{ runner.os }}-libcasm-clexulator-v2-0a5
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key: ${{ runner.os }}-libcasm-clexulator-v2-0-0
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- name: Install CASM dependencies
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run: |

‎.github/workflows/test-macos-build.yml‎

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- uses: actions/checkout@v4
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- uses: actions/setup-python@v5
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with:
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python-version: '3.11'
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python-version: '3.13'
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- name: Set up requirements & configuration variables
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run: |

‎.github/workflows/test-macos.yml‎

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- uses: actions/checkout@v4
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- uses: actions/setup-python@v5
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with:
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python-version: '3.11'
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python-version: '3.13'
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- name: Set up requirements & configuration variables
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run: |

‎CHANGELOG.md‎

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The format is based on [Keep a Changelog](https://keepachangelog.com/en/1.1.0/),
66
and this project adheres to [Semantic Versioning](https://semver.org/spec/v2.0.0.html).
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8+
## [2.0.0] - 2025-05-03
9+
10+
### Changed
11+
12+
- Build for Python 3.13
13+
- Restrict requires-python to ">=3.9,<3.14"
14+
- Run CI tests using Python 3.13
15+
- Build MacOS arm64 wheels using MacOS 15
16+
- Build Linux wheels using Ubuntu 24.04
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18+
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## [2.0a8] - 2025-02-10
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### Fixed

‎build_requirements.txt‎

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cmake>=3.20
55
ninja
66
pybind11>=2.6
7-
libcasm-global>=2.0.5
8-
libcasm-xtal>=2.0a12
9-
libcasm-clexulator>=2.0a5
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libcasm-global>=2.0.6
8+
libcasm-xtal>=2.0.0
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libcasm-clexulator>=2.0.0

‎pyproject.toml‎

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"cmake>=3.20",
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"ninja",
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"pybind11>=2.6",
9-
"libcasm-global>=2.0.5",
10-
"libcasm-xtal>=2.0a12",
11-
"libcasm-clexulator>=2.0a5",
9+
"libcasm-global>=2.0.6",
10+
"libcasm-xtal>=2.0.0",
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"libcasm-clexulator>=2.0.0",
1212
]
1313
build-backend = "setuptools.build_meta"
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[project]
1616
name = "libcasm-configuration"
17-
version = "2.0a8"
17+
version = "2.0.0"
1818
authors = [
1919
{ name="CASM developers", email="casm-developers@lists.engr.ucsb.edu" },
2020
]
2121
description = "CASM configuration comparison and enumeration"
2222
readme = "README.md"
23-
requires-python = ">=3.9"
24-
license = {text = "LGPL2.1+"}
23+
requires-python = ">=3.9,<3.14"
24+
license = "LGPL-2.1-or-later"
2525
classifiers = [
26-
"Development Status :: 3 - Alpha",
26+
"Development Status :: 5 - Production/Stable",
2727
"Programming Language :: Python :: 3",
2828
"Programming Language :: C++",
29-
"License :: OSI Approved :: GNU Lesser General Public License v2 or later (LGPLv2+)",
3029
"Topic :: Scientific/Engineering",
3130
]
3231
dependencies = [
33-
"libcasm-global>=2.0.5",
34-
"libcasm-xtal>=2.0a12",
35-
"libcasm-clexulator>=2.0a5",
32+
"libcasm-global>=2.0.6",
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"libcasm-xtal>=2.0.0",
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"libcasm-clexulator>=2.0.0",
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"numpy",
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"spglib",
3837
]
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[tool.cibuildwheel]
56-
# Build for python3.9, 3.10, 3.11, 3.12
57-
build = "cp39-* cp310-* cp311-* cp312-*"
55+
# Build for python3.9, 3.10, 3.11, 3.12, 3.13
56+
build = "cp39-* cp310-* cp311-* cp312-* cp313-*"
5857
# Build for cpython only
5958
skip = "pp*"
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# Need libcasm dependencies at wheel repair stage
6261
before-build = "pip install -r build_requirements.txt"
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6463
# Testing
65-
test-requires = "pytest pytest-datadir sortedcontainers libcasm-mapping>=2.0a4"
64+
test-requires = "pytest pytest-datadir sortedcontainers libcasm-mapping>=2.0.0"
6665
test-command = "pytest -rsap {project}/python/tests"
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[tool.cibuildwheel.macos]

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