Symmetry in Crystal Structure Prediction
- đ¤ Speaker: James Darby, CUED
- đ Date & Time: Friday 05 February 2021, 14:00 - 14:30
- đ Venue: Zoom Meeting ID: 819 1682 8857
Abstract
The aim of computational crystal structure prediction is to find the lowest energy periodic arrangement of a given set of building units. This talk will focus on how symmetry constraints can be applied when the building units are symmetric molecules and then move on to discuss how symmetry constraints can bias a search.Â
Series This talk is part of the Engineering - Mechanics and Materials Seminar Series series.
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- Zoom Meeting ID: 819 1682 8857
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Friday 05 February 2021, 14:00-14:30