Interfaces ========== `Molden`_ 3D plots of Molecular Orbitals FCIDUMP Interface with the FCI-QMC program `NECI`_, or the semi-stochastic Heat-Bath CI program `Dice`_. `GAMESS`_ / Gaussian Using the resultsFile Python library, the geometr and molecular orbitals can be read. This is useful to make calculations with CAS-SCF orbitals `QMCPack`_ / `CHAMP`_ / `QMC=Chem`_ Trial wave functions can be used for Quantum Monte Carlo, with or without pseudo-potentials. .. _Molden: http://cheminf.cmbi.ru.nl/molden/ .. _GAMESS: https://www.msg.chem.iastate.edu/gamess/ .. _QMC=Chem: https://gitlab.com/scemama/qmcchem .. _CHAMP: https://www.utwente.nl/en/tnw/ccp/research/CHAMP.html .. _NECI: https://github.com/ghb24/NECI_STABLE .. _Dice: https://sanshar.github.io/Dice/ .. _QMCPack: https://qmcpack.org