2023 VWSCC Session 02: Introduction to IQmol
Presented by Shannon Houck on
In this workshop, Shannon Houck (Q-Chem) gives a crash course and demonstration in IQmol, Q-Chem's graphical user interface. This tutorial gives a brief overview in building molecules, submitting calculations to the Q-Chem server, and analyzing results.
There is a lab section associated with this workshop. Please find the relevant lab materials (a PDF with instructions, along with sample input/output files) on Google Drive here.
This talk was given as part of the 2023 VWSCC Q-Chem Workshop and is reposted here with permission.