Gaussian: Tutorial on Water Single Point Energy and the Command Line
Description: Table of Contents Introduction Setup on the Available Clusters Run Gaussian in scratch space Tutorial Steps Running Gaussian on the Clusters Additional Links Introduction You can use command line execution to create and save a Gaussian input file. Below is an example based on restricted Hartree-Fock calculations on a 6-31G(d) basis set for water single […]
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Research Computing: Contact Us
Description: By Web Complete the web form Submit a Help Request.  In the “Choose the Department or Service you need assistance with” drop-down, select ITS Services then under “Type of Help Needed” drop-down, select Research Computing. In the Problem Description box, describe the problem and specify your operating system (Linux, Windows, etc.), the name/version of the […]
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