atomate2
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GW-BSE calculation with Abinit
Summary
Include a summary of major changes in bullet points:
- Feature:
- GW-BSE calculation with Abinit
- GW workflow includes convergence tests for important parameters like the number of empty bands
- BSE workflow has the option to choose model dielectric function or full screening matrix to use
- BSE workflow includes convergence with respect to the number of k-points.
Additional dependencies introduced (if any)
No additional dependencies
TODO (if any)
Need to move /atomate2/abinit/sets/factories.py to abipy/abio/factories.py