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GPAW Example


GPAW is a wave and molecular solver based on the Projector-Augmented Wave (PAW) method.


Post processing visualization of results/gpaw-fcc-silver-example/Ag-eos.png "Post processing visualization of results")

Post processing visualization of results


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Simulation Code GPAW 0.10.0 or newer (1.1.0 in linked example)
Analysis Type Solid-state physics
Description GPAW example using MPI: equation of state of FCC silver
Suggested Hardware Nickel / 1 core (2 cores in linked example)
Command mpirun -np 1 gpaw-python eos1-gpaw.pygpaw-python eos2-gpaw.py
Estimated Run Time 5 minutes (< 3 min in linked example)
Contributor Marcin Dulak

Last Updated: Dec 02, 2016 02:16PM PST

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