An Open Science Grid Implementation of the Steady State Genetic Algorithm for Crystal Structure Prediction

Research by K. N. Varela^1,2, G. I. Pagola^1,2, M. B. Ferraro^1,2, A. M. Lund^3,4, A. M. Orendt³, and J. C. Facelli⁴

¹Universidad de Buenos Aires, Facultad de Ciencias Exactas y Naturales, Departamento de Física, Buenos Aires, Argentina; ²CONICET - Universidad de Buenos Aires, Instituto de Física de Buenos Aires (IFIBA), Buenos Aires, Argentina; ³Center for High Performance Computing, University of Utah, Salt Lake City, UT, USA; ⁴Department of Biomedical Informatics, University of Utah, Salt Lake City, UT, USA

Varela, Pagola, Ferraro, Lund, Orendt, and Facelli implemented a steady-state genetic algorithm for crystal structure prediction with Open Science Grid resources for computation. More information is available in a poster provided by the group.