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Development of parallel density functional program using distributed matrix to calculate all-electron canonical wavefunction of large molecules.
Toru Inaba
Fumitoshi Sato
Published in:
J. Comput. Chem. (2007)
Keyphrases
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distributed processing
cooperative
knowledge based systems
programming environments
case study
software engineering
computer programs
information processing
singular value decomposition
fault tolerant
low rank
canonical form
distributed systems
distributed environment
development process
parallel implementation