MOLCAS

Molcas is an ab initio quantum chemistry software package developed by scientists to be used by scientists.

Quantum chemistry software · by Lund University · molcas.org

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What MOLCAS’s own pages say

What it says it doesMolcas is an ab initio quantum chemistry software package developed by scientists to be used by scientists. molcas.org
Models supportedCASPT2/RASPT2, CASSCF/RASSCF, SCF/DFT molcas.org

Each value is a quote AirStack found on the product’s own pages, read 2026-11-05. A missing field means AirStack has not found it on its pages.