Modified NWChem Code Utilizes Supercomputer Parallelization

This is the first in a series of articles, told from the perspective of individuals who are updating codes, that describes changes various national laboratories and scientific research centers are making to improve code optimization and parallelization in order to reduce time to discovery. NWChem is...

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Veröffentlicht in:	Scientific Computing
1. Verfasser:	Barney, Linda
Format:	Trade Publication Article
Sprache:	Englisch
Veröffentlicht:	Rockaway Advantage Business Media 23.03.2016
Schlagworte:	Algorithms Catalysis Cellulose Chemistry Codes Computational chemistry Energy research Laboratories Modernization Open source software R&D Research & development Simulation Supercomputers Teams
ISSN:	1930-5753, 1930-6156
Online-Zugang:	Volltext
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