Multiwfn < WORKING ⚡ >

A key strength of Multiwfn is its ability to interface with nearly all major quantum chemistry software.

: Support for the Quantum Theory of Atoms in Molecules (QTAIM) , Non-Covalent Interaction (NCI) index, and Independent Gradient Model (IGM) to visualize and quantify chemical bonds and weak intermolecular forces. multiwfn

Multiwfn is famous for its compatibility. It can read output files (or formatted checkpoint files) from almost all major quantum chemistry packages: A key strength of Multiwfn is its ability