Journal article Open Access

Multiple-Time Step Ab Initio Molecular Dynamics Based on Two-Electron Integral Screening

Fatehi, Shervin; Steele, Ryan P.


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@article{fatehi_shervin_2015_5486251,
  author       = {Fatehi, Shervin and
                  Steele, Ryan P.},
  title        = {{Multiple-Time Step Ab Initio Molecular Dynamics 
                   Based on Two-Electron Integral Screening}},
  journal      = {Journal of Chemical Theory and Computation},
  year         = 2015,
  volume       = 11,
  number       = 3,
  pages        = {884-898},
  month        = feb,
  doi          = {10.1021/ct500904x},
  url          = {https://doi.org/10.1021/ct500904x}
}
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