Publication

L. Grajciar, P. Nachtigall, O. Bludský, and M. Rubeš,
Accurate Ab Initio Description of Adsorption on Coordinatively Unsaturated Cu2\mathplus and Fe3\mathplus Sites in MOFs

Journal of Chemical Theory and Computation, 11(1), 2014

DOI, BibTeX

Reference

@article{Grajciar_2014,
  author = "L. Grajciar and P. Nachtigall and O. Bludský and M. Rubeš",
  title = "Accurate Ab Initio Description of Adsorption on Coordinatively Unsaturated Cu2$\mathplus$ and Fe3$\mathplus$ Sites in {MOFs}",
  year = 2014,
  journal = "Journal of Chemical Theory and Computation",
  publisher = "American Chemical Society (ACS)",
  volume = 11,
  number = 1,
  month = "Dec",
  doi = "10.1021/ct500711z",
  url = "https://doi.org/10.1021%2Fct500711z"
}