Implementation of SAFT-VRQ Mie EoS#79

Merged

g-bauer merged 10 commits intofeos-org:mainfrom

morteham:saftvrqmie

Dec 4, 2022

Commits on Nov 25, 2022

Added SAFT-VRQ Mie EOS and DFT functional
morteham
committed

Commits on Nov 28, 2022

added documentation, minor refactoring incl. clippy suggestions
g-bauer
committed

Commits on Nov 29, 2022

updated README, added README for parameters, renamed parameter files, updated CI
g-bauer
committed
added dft feature to dispersion energy density
g-bauer
committed
added function to generate lammps tables from parameters incl. python binding
g-bauer
committed

Commits on Nov 30, 2022

Added tutorial on how to compute the rdf using DFT and comparison to LAMMPS output, added Python docstrings for functional constructor
g-bauer
committed