Add FFTW3 dev library requirement to README.rst #20
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name: postqe | |
on: | |
push: | |
branches: [master, develop] | |
pull_request: | |
branches: [master, develop] | |
jobs: | |
build: | |
runs-on: ${{ matrix.os }} | |
strategy: | |
fail-fast: false | |
matrix: | |
os: [ubuntu-latest] | |
python-version: ["3.11"] | |
steps: | |
- uses: actions/checkout@v3 | |
- name: Set up Python ${{ matrix.python-version }} | |
uses: actions/setup-python@v3 | |
with: | |
python-version: ${{ matrix.python-version }} | |
- name: Install pip, setuptools and wheel | |
run: | | |
python -m pip install --upgrade pip | |
pip install setuptools | |
pip install wheel | |
- name: Lint with flake8 | |
run: | | |
pip install flake8 | |
flake8 src/postqe --max-line-length=120 --statistics | |
- name: Download Quantum ESPRESSO 7.2 | |
run: | | |
curl -LJO https://github.com/QEF/q-e/archive/refs/tags/qe-7.2.zip | |
sha256sum q-e-qe-7.2.zip | grep 1938b5c998e1485564b54b6eb27db31b2686ca8d8cb71a50afc50fe6adef07fc | |
- name: Unzip Quantum ESPRESSO 7.2 | |
run: | | |
unzip -q q-e-qe-7.2.zip | |
rm q-e-qe-7.2.zip | |
- name: Install lapack and fftw3 libs | |
run: | | |
sudo apt-get update -y | |
sudo apt install liblapack-dev libfftw3-dev | |
- name: Install postqe | |
run: | | |
export QE_TOPDIR=`realpath q-e-qe-7.2` | |
pip install . | |
- name: Test with unittest | |
run: | | |
python -m unittest | |