Case Study: Molecular Modelling Using High Performance Computing and Gaussian

Gaussian software allows you to study the properties of molecules and their reactions, particulary in conditions which are difficult or impossible to observe experimentally. Gaussian is regularly used by Dr. Gino DiLabio, an Adjunct Professor in the Department of Physics at the University of Alberta. In this talk, DiLabio will highlight some of the top computational challenges his lab encounters and explain how his use of Gaussian on WestGrid computing facilities helps his research team overcome them. This one-hour talk will be presented via the videoconference facilities in Mathematical Sciences 337. For more information, please see https://www.westgrid.ca/events/molecular-modelling-using-HPC-and-Gaussian Note that WestGrid (www.westgrid.ca) computing facilities are available to approved University of Calgary researchers regardless of discipline. You are welcome to stay and talk to local support staff about your research computing needs after the presentation.

Location:

Mathematical Sciences 337

Speaker:

Gino DiLabio (Adjunct Professor, Department of Physics, University of Alberta)

More information at http://www.ucalgary.ca/events/calendar/case-study-molecular-modelling-using-high-performance-computing-and-gaussian