multiwfn

Multifunctional wavefunction analysis for quantum chemistry

Multiwfn is an extremely powerful program for realizing electronic wavefunction analysis, which is a key ingredient of quantum chemistry. Multiwfn is free, open-source, high-efficient, very user-friendly and flexible, it supports almost all of the most important wavefunction analysis methods. 64 bit Windows, Linux and Mac OS platforms are supported. This port represents the GNU fortran-compatible fork of Multiwfn, which is normally using the Intel fortran (ifort).