Additionally, simultaneous citation of the following relevant papers is highly recommended when specific analysis modules are used:
The modified IGM (mIGM) recently proposed by Tian Lu has been fully supported in Multiwfn 3.8.
Analyzes molecular orbital contributions using NAO, Mulliken, SCPA, and Hirshfeld-dominant methods. 4. Surface Analysis and Electrostatics
Disclaimer: Multiwfn is free for academic use, but proper citation of the software is necessary (Tian Lu, J. Chem. Phys., 161, 082503 (2024)). multiwfn 3.8 download
Easy Download and Installation of Multiwfn 3.8
The software is packaged in compressed archives.
Perform Mulliken, Löwdin, Hirshfeld, Becke, and ChelpG atomic charge calculations. Easy Download and Installation of Multiwfn 3
Version 3.8 introduces significant enhancements to its analysis capabilities:
Choose the binary package that matches your operating system:
Multiwfn input.fch -nt 36
. No formal installation is required, though adding the folder to your system's environment variables is recommended for command-line access. macOS/Linux
A Mega net disk link is sometimes provided for users having trouble with the main site, though the official page remains the primary source for the most up-to-date files.
This uses a slower but less memory-intensive ESP evaluation code. Despite being a mature version
Despite being a mature version, users encounter a few recurring problems:
Comprehensive Guide to Multiwfn 3.8: Features, Applications, and Download Guide