Simulations in the era of exascale computing
C. S. Chang, Volker L. Deringer, Kalpana S. Katti, Véronique Van Speybroeck, Christopher Wolverton
Topics & Concepts
SupercomputerFrontierExascale computingComputer scienceChinaFLOPSPoint (geometry)Computational scienceEngineering physicsParallel computingPolitical sciencePhysicsLawMathematicsGeometryMachine Learning in Materials ScienceElectronic and Structural Properties of OxidesCatalysis and Oxidation Reactions