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Electrical property of a sulfuric acid-water mixture from the first-principles molecular dynamics simulation.

Yoong-Kee ChoeEiji TsuchidaTamio Ikeshoji
Published in: Comput. Phys. Commun. (2007)
Keyphrases
  • molecular dynamics
  • molecular dynamics simulations
  • high performance computing
  • protein folding
  • scientific data
  • data mining
  • computer vision
  • fluid flow