392186 Accelerating Materials Discovery and Development for Fossil Energy Applications Using High-Throughput Computation

Tuesday, November 18, 2014: 1:30 PM
M101 (Marriott Marquis Atlanta)
David S. Sholl, School of Chemical & Biomolecular Engineering, Georgia Institute of Technology, Atlanta, GA

Many technological challenges associated with fossil energy applications require the development of new materials, and this task frequently requires choosing appropriate materials from a very large number of candidate materials. Significant efforts have been made to aid this kind of task by combining predictive materials modeling with high-throughput computational techniques. I will discuss examples of progress in this area and consider the challenges that exist for using computational modeling most efficiently within technology development

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