Seminars & Events

Argonne Leadership Computing Facility Seminar
"Real Space Calculations with the Projector Augmented Wave Method"

DATE: December 10, 2008
TIME: 10:30 am
SPEAKER: Jens Jorgen Mortensen, Department of Physics, Technical University of Denmark
LOCATION: Building 360 Conference Room L119, Argonne National Laboratory

Description:
The PAW method is the next-generation pseudo-potential method for doing density functional theory calculations. GPAW is a Python/C implementation of the PAW method, based on real-space uniform grids and multigrid methods, suitable for massive parallelization.

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