NeuDATool: An Open Source Neutron Data Analysis Tools, Supporting GPU Hardware Acceleration, and Across-computer Cluster Nodes Parallel
Changli Ma,
He Cheng,
Taisen Zuo
et al.
Abstract:Empirical potential structure refinement (EPSR) is a neutron scattering data analysis algorithm and a software package. It was developed by the British spallation neutron source (ISIS) Disordered Materials Group in 1980s, and aims to construct the most-probable atomic structures of disordered liquids. It has been extensively used during the past decades, and has generated reliable results. However, it is programmed in Fortran and implements a shared-memory architecture with OpenMP. With the extensive construct… Show more
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