mirror of
https://github.com/pfloos/quack
synced 2024-12-22 12:23:50 +01:00
51 lines
1014 B
YAML
51 lines
1014 B
YAML
name: QuAcK CI
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on:
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push:
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branches:
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- master
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pull_request:
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branches:
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- '**'
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schedule:
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- cron: "42 19 * * 6"
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jobs:
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build:
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runs-on: ubuntu-20.04
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name: Compilation and Tests
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steps:
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- name: Checkout repository
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uses: actions/checkout@v3
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- name: Install dependencies
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run: |
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sudo apt-get update
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sudo apt-get install -y gfortran gcc liblapack-dev libblas-dev wget python3 make m4 pkg-config
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- name: Configuration
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run: |
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./configure -i ninja || :
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- name: Compilation
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run: |
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bash -c "source quack.rc ; cd src ; make ; cd .. "
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- name: Set up Python
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uses: actions/setup-python@v4
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with:
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python-version: '3.x'
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- name: Install Python dependencies
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run: |
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python -m pip install --upgrade pip
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pip install pyscf
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- name: Run tests
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run: |
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bash -c "source quack.rc ; cd tests ; python create_database.py ; python lunch_bench.py -s light -t 1e-1"
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