articleComputational Materials ScienceJan 4, 2016Closed access

An implementation of artificial neural-network potentials for atomistic materials simulations: Performance for TiO2

NANongnuch ArtrithAUAlexander Urban

Massachusetts Institute of Technology

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Topics
Keywords
  • Brookite
  • Anatase
  • Artificial neural network
  • Baddeleyite
  • Rutile
  • Materials science
  • Columbite
  • Computer science
UN Sustainable Development Goals
  • Affordable and clean energy
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