PCMSOLVER¶
| Input File | Description |
|---|---|
| pcmsolver/ccsd-pte | coupled-cluster with PCM |
| pcmsolver/opt-fd | PCM-SCF STO-3G geometry optimization by finite differences, with Z-matrix input |
| pcmsolver/dipole | dipole moment for HF and B3LYP in presence of perturbation |
| pcmsolver/dft | pcm |
| pcmsolver/scf | pcm |