Implementing molecular dynamics on hybrid high performance computers - short range forces. - W. Michael Brown; Peng Wang; Steven J. Plimpton; Arnold N. Tharrington (Comput. Phys. Commun., 2011)

Implementing molecular dynamics on hybrid high performance computers - Particle-particle particle-mesh. - W. Michael Brown; Axel Kohlmeyer; Steven J. Plimpton; Arnold N. Tharrington (Comput. Phys. Commun., 2012)

Developing MiniApps on Modern Platforms Using Multiple Programming Models. - O. E. Bronson Messer; Eduardo F. D'Azevedo; Judith C. Hill; Wayne Joubert; S. Laosooksathit; Arnold N. Tharrington (CLUSTER, 2015)

Accelerated application development: The ORNL Titan experience. - Wayne Joubert; Rick Archibald; Mark A. Berrill; W. Michael Brown; Markus Eisenbach 002; Ray W. Grout; Jeff Larkin; John M. Levesque; Bronson Messer; Matthew R. Norman; Bobby Philip; Ramanan Sankaran; et al. (Comput. Electr. Eng., 2015)

Experiences Evaluating Functionality and Performance of IBM POWER8+ Systems. - Verónica G. Vergara Larrea; Wayne Joubert; Mark A. Berrill; Swen Boehm; Arnold N. Tharrington; Wael R. Elwasif; Don E. Maxwell (ISC Workshops, 2017)

Using Compiler Directives for Performance Portability in Scientific Computing: Kernels from Molecular Simulation. - Ada Sedova; Andreas F. Tillack; Arnold N. Tharrington (WACCPD@SC, 2018)

Scaling the Summit: Deploying the World's Fastest Supercomputer. - Verónica G. Vergara Larrea; Wayne Joubert; Michael J. Brim; Reuben D. Budiardja; Don Maxwell; Matthew Ezell; Christopher Zimmer 001; Swen Boehm; Wael R. Elwasif; Sarp Oral; Chris Fuson; Daniel Pelfrey; et al. (ISC Workshops, 2019)

Porting Adaptive Ensemble Molecular Dynamics Workflows to the Summit Supercomputer. - John R. Ossyra; Ada Sedova; Arnold N. Tharrington; Frank Noé; Cecilia Clementi; Jeremy C. Smith (ISC Workshops, 2019)

Ready for the Frontier: Preparing Applications for the World's First Exascale System. - Reuben D. Budiardja; Mark A. Berrill; Markus Eisenbach 002; Gustav R. Jansen; Wayne Joubert; Stephen Nichols; David M. Rogers 001; Arnold N. Tharrington; O. E. Bronson Messer (ISC, 2023)

Studying performance portability of LAMMPS across diverse GPU-based platforms. - Nick Hagerty; Verónica G. Melesse Vergara; Arnold N. Tharrington (Concurr. Comput. Pract. Exp., 2023)