Interaction of dislocation with GP zones or θ" phase precipitates in aluminum: Atomistic simulations and dislocation dynamics

Fast Parallel Algorithms for Short-Range Molecular Dynamics

Steven J. Plimpton · Journal of Computational Physics · 1995 · 44.6K citations

Computing, High-performance Computing, Physics +10

Molecular dynamics with coupling to an external bath

Herman J. C. Berendsen, Johan P. M. Postma, Wilfred F. van Gunsteren et al. · The Journal of Chemical Physics · 1984 · 31K citations · Full text

Natural Sciences, Chemistry, Physics +17

Visualization and analysis of atomistic simulation data with OVITO–the Open Visualization Tool

Alexander Stukowski · Modelling and Simulation in Materials Science and Engineering · 2009 · 16.1K citations

Natural Sciences, Chemistry, Visualization +17

Automated identification and indexing of dislocations in crystal interfaces

Alexander Stukowski, Vasily V. Bulatov, A. Arsenlis · Modelling and Simulation in Materials Science and Engineering · 2012 · 2.3K citations · Full text

Natural Sciences, Materials Engineering, Materials Science +16

Atomsk: A tool for manipulating and converting atomic data files

Pierre Hirel · Computer Physics Communications · 2015 · 2.2K citations

Computing, Computer Science, Atomic Physics +7