Files

All files involved in this tutorial as well as pdf verison of this tutorial can be downloaded at http://sobereva.com/multiwfn/res/IGMH_tutorial.zip

Tutorial of using Multiwfn to perform IGMH analysis

First release: 2021-Nov-25   |   Last update: 2025-Nov-24

Tian Lu (sobereva@sina.com)

Beijing Kein Research Center for Natural Sciences (http://www.keinsci.com)

Citation Information

If Multiwfn is used in your work to perform IGMH analysis, please cite original papers of Multiwfn, which are shown on screen when Multiwfn boots up; and also cite original papers of the IGMH method:

Reading and citing the following review articles are also highly recommended, which carefully introduced the IGMH method:

  • Tian Lu, Visualization Analysis of Covalent and Noncovalent Interactions in Real Space, Angew. Chem. Int. Ed., 137, e202504895 (2025) DOI: 10.1002/anie.202504895
  • Tian Lu, Qinxue Chen, Visualization Analysis of Weak Interactions in Chemical Systems (2023), in Comprehensive Computational Chemistry, Vol. 2 pp. 240-264. Oxford: Elsevier. DOI: 10.1016/B978-0-12-821978-2.00076-3