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SPARC: Accurate and efficient finite-difference formulation and parallel implementation of Density Functional Theory: Extended systems.

Swarnava GhoshPhanish Suryanarayana
Published in: Comput. Phys. Commun. (2017)
Keyphrases
  • parallel implementation
  • finite difference
  • finite element
  • numerical solution
  • partial differential equations
  • level set
  • multiscale
  • pairwise
  • linear systems
  • parallel computers
  • parallel architectures