Add GFN-FF charge initialization options (#315) #18

	name: CMake build and unit tests
	on: [push, pull_request]

	env:
	BUILD_DIR: _build

	jobs:
	gcc-cmake-build:
	runs-on: ${{ matrix.os }}
	strategy:
	fail-fast: false
	matrix:
	os: [ubuntu-latest]
	fc: [gfortran-10]
	cc: [gcc-10]

	steps:
	- name: Checkout code
	uses: actions/checkout@v4

	- name: Setup Python
	uses: actions/setup-python@v4
	with:
	python-version: 3.x

	- name: Install CMake
	run: pip3 install cmake

	- name: Git Sumbodules Setup
	run: \|
	git submodule update --init

	- name: Configure build
	run: cmake -B ${{ env.BUILD_DIR }}
	env:
	FC: ${{ matrix.fc }}
	CC: ${{ matrix.cc }}

	- name: Build project
	run: cmake --build ${{ env.BUILD_DIR }}

	- name: Run unit tests
	run: make test
	working-directory: ${{ env.BUILD_DIR }}
	env:
	OMP_NUM_THREADS: 2,1

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