DAMQT_2.2.0
Published: 8 May 2018| Version 3 | DOI: 10.17632/rpzbrppywy.3
Contributors:
Rafael Lopez, Jaime Fernández-Rico, , , , , , , , Description
Package for the visualization and analysis of molecular electron density (MED) and related properties including electrostatic field (MESP) and Hellmann-Feynman forces. Incorporates facilities for the topological analysis of MED and MESP.
Files
Steps to reproduce
Sample decks are included in the samples directory for testing. A Quick Start document is included in the doc directory. Manual included in the doc directory
Categories
Molecular Bonding, Molecular Design