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Petascale Computations for Large-Scale Atomic and Molecular Collisions

Brendan M. McLaughlin () and Connor P. Ballance ()
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Brendan M. McLaughlin: School of Mathematics & Physics, Queen’s University, Centre for Theoretical Atomic, Molecular and Optical Physics (CTAMOP)
Connor P. Ballance: Auburn University, Department of Physics

A chapter in Sustained Simulation Performance 2014, 2015, pp 173-185 from Springer

Abstract: Abstract Petaflop architectures are currently being utilized efficiently to perform large scale computations in Atomic, Molecular and Optical Collisions. We solve the Schrödinger or Dirac equation for the appropriate collision problem using the R-matrix or R-matrix with pseudo-states approach. We briefly outline the parallel methodology used and implemented for the current suite of Breit-Pauli and DARC codes. Various examples are shown of our theoretical results compared with those obtained from Synchrotron Radiation facilities and from Satellite observations. We also indicate future directions and implementation of the R-matrix codes on emerging GPU architectures.

Keywords: Photoionization Cross Section; Cataclysmic Variable; Advance Light Source; High Resolution Experiment; Accurate Cross Section (search for similar items in EconPapers)
Date: 2015
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Persistent link: https://EconPapers.repec.org/RePEc:spr:sprchp:978-3-319-10626-7_15

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DOI: 10.1007/978-3-319-10626-7_15

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