Multiwfn 3.7 freeware

Multiwfn is a user-friendly, powerful and flexible program that aims for general wavefunction analysis. Multiwfn accepts several kinds of files as wavefunction input: .wfn/.wfx (Conventional / Extended PROAIM wavefunction file), .31~.40
(NBO plot file), .fch (Gaussian formatted check file).

Author sobereva
Released 2020-08-14
Filesize 15.90 MB
Downloads 439
OS Windows Vista, Windows Vista x64, Windows 7, Windows 7 x64, Windows 8, Windows 8 x64, Windows 10, Windows 10 x64
Installation Instal And Uninstall
Keywords wavefunction analysis, topology analysis, molecular structure, analysis, analize, wavefunction
Users' rating
(4 rating)
Multiwfn - Freeware Download Notice

Multiwfn Free Download - we do not host any Multiwfn torrent files or links of Multiwfn on rapidshare.com, depositfiles.com, megaupload.com etc. All Multiwfn download links are direct Multiwfn download from publisher site or their selected mirrors.

Multiwfn freeware - The Latest User Reviews
Multiwfn freeware - The Latest Versions History
3.7 Aug 14, 2020 New Release
3.6 May 21, 2019 New Release A very powerful and easy-to-use RESP module is added into main function 7 (Population analysis). It can calculate the well-known ElectroStatic Potential (RESP) charge proposed in J. Phys. Chem., 97, 10269 (1993), and can also calculate ESP fitting charges under various customized conditions such as atomic equivalence constraint and fragment charge constraint. Multiple conformation is fully supported. See Section 3.9.16 for detailed introduction and Section 4.7.7 for examples. This module should be able to bring a revolution in the field of RESP charge derivation.
Energy decomposition analysis based on UFF/AMBER/GAFF molecular forcefield is supported as subfunction 1 of main function 21. See corresponding introduction in Section 3.24.1 and examples in Section 4.21.1 of the manual.
2.4 May 23, 2012 New Release · Fixed a bug introduced by Version 2.2.1 (that is Multiwfn crashes during reading the .fch files produced by unrestricted calculation with cartesian basis functions)
· Fixed a bug in the interface for selecting the interbasin surfaces to be generated
· A serious bug in reading the .fch files produced by unrestricted calculation with spherical basis functions is solved
· Merz-Kollmann charge is supported in population module
· Option 10 is added to topology analysis module, this is a small tool used to calculate Shannon aromaticity index

Most popular CAD freeware downloads

MarvinSketch

6.3.0 freeware download

An advanced chemical editor for drawing chemical structures, queries

ShelXle

1.0 Rev 1290 freeware download

Combines an editor with syntax highlighting for the SHELXL-associated .ins

New Version

TNTatlas for Mac OS X

2021 B20210721 freeware download

Designed to help you view hierarchical atlases by analyzing them

New Version

TNTatlas

2021 B20210721 freeware download

Designed to help you view hierarchical atlases by analyzing them

New Version

Sweet Home 3D

6.6 freeware download

A free interior design application helping you placing your furniture

New Version

TNTmips for Mac OS X

2021 B20210721 freeware download

Analyze complex GIS data, process and modify map images

New Version

TNTmips

2021 B20210721 freeware download

Analyze complex GIS data, process and modify map images

New Version

ProfiCAD

11.2.2 freeware download

Software for electrical diagrams, schematics and other technical documents

LTspice IV

XVII July 27 20 freeware download

A software to help you simulate switching regulators

New Version

Panoply for Mac

4.12.9 freeware download

Quickly plot images for the latitude-longitude data contained by netCDF datasets