Optimizing the Performance of Reactive Molecular Dynamics Simulations for Multi-Core Architectures. - Hasan Metin Aktulga; Christopher Knight 001; Paul K. Coffman; Kurt A. O'Hearn; Tzu-Ray Shan; Wei Jiang (CoRR, 2017)

Optimizing the performance of reactive molecular dynamics simulations for many-core architectures. - Hasan Metin Aktulga; Chris Knight 001; Paul K. Coffman; Kurt A. O'Hearn; Tzu-Ray Shan; Wei Jiang (Int. J. High Perform. Comput. Appl., 2019)