Quantemol-N Tutorial videos
Quantemol-N, electron molecule cross-section calculations.
Basic tutorial
Some of the input data can be found on the NIST web site, see tutorial on this
Using the NIST database
Using right basis set for your calculations is one of the key elements to get good results. Below is a tutorial on how to set up basis set and advice on choosing best basis set.
Setting up basis sets
Analysing results
Output directories guidance video could be found here
Output directories
Optional quick software set-up Quantemol-N Express program demo:
Quantemol-N Express Demonstration