Evolutionary optimization of PAW data-sets for accurate high pressure simulations

Kanchan Sarkar, Mehmet Topsakal, N. A. W. Holzwarth, Renata M. Wentzcovitch. Evolutionary optimization of PAW data-sets for accurate high pressure simulations. J. Comput. Physics, 347:39-55, 2017. [doi]

Abstract

Abstract is missing.