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Is the error on first-principles volume predictions absolute or relative?

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UNCERTAINTY, CRYSTALS, DENSITY-FUNCTIONAL APPROXIMATIONS, CHEMISTRY, Density-functional theory, Crystal volume, Uncertainty quantification, Equation of state

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Citation

Please use this url to cite or link to this publication:

Chicago
Lejaeghere, Kurt, Louis Vanduyfhuys, Toon Verstraelen, Veronique Van Speybroeck, and Stefaan Cottenier. 2016. “Is the Error on First-principles Volume Predictions Absolute or Relative?” Computational Materials Science 117: 390–396.
APA
Lejaeghere, K., Vanduyfhuys, L., Verstraelen, T., Van Speybroeck, V., & Cottenier, S. (2016). Is the error on first-principles volume predictions absolute or relative? COMPUTATIONAL MATERIALS SCIENCE, 117, 390–396.
Vancouver
1.
Lejaeghere K, Vanduyfhuys L, Verstraelen T, Van Speybroeck V, Cottenier S. Is the error on first-principles volume predictions absolute or relative? COMPUTATIONAL MATERIALS SCIENCE. 2016;117:390–6.
MLA
Lejaeghere, Kurt et al. “Is the Error on First-principles Volume Predictions Absolute or Relative?” COMPUTATIONAL MATERIALS SCIENCE 117 (2016): 390–396. Print.
@article{7192962,
  author       = {Lejaeghere, Kurt and Vanduyfhuys, Louis and Verstraelen, Toon and Van Speybroeck, Veronique and Cottenier, Stefaan},
  issn         = {0927-0256},
  journal      = {COMPUTATIONAL MATERIALS SCIENCE},
  keywords     = {UNCERTAINTY,CRYSTALS,DENSITY-FUNCTIONAL APPROXIMATIONS,CHEMISTRY,Density-functional theory,Crystal volume,Uncertainty quantification,Equation of state},
  language     = {eng},
  pages        = {390--396},
  title        = {Is the error on first-principles volume predictions absolute or relative?},
  url          = {http://dx.doi.org/10.1016/j.commatsci.2016.01.039},
  volume       = {117},
  year         = {2016},
}

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