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Accelerated molecular dynamics force evaluation on graphics processing units for thermal conductivity calculations.
Zheyong Fan
Topi Siro
Ari Harju
Published in:
Comput. Phys. Commun. (2013)
Keyphrases
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molecular dynamics
high performance computing
thermal conductivity
graphics processing units
general purpose
parallel implementation
massively parallel
real time
data analysis
graphical models
computer systems
theoretical analysis
computing systems
fluid flow