Molden: program mainly used to display electron density from quancum-mechanical (e.g., Gaussian) calculations
Molden can be downloaded from http://www.cmbi.ru.nl/molden/
A brief tutorial (with examples of plots) can be found at http://www.cmbi.ru.nl/molden/density.html
To generate an input file, you have to run Gaussian. In the line of the Gaussian options you have to add
Pop=CHelpG GFINPUT IOP(6/7=3)
The output file produced by the Gaussian run should be inputted to Molden via the Read button.
|Last modified: 10/06/2014||Go to Mezei Lab Home page|