Transferable Classical Force Field for Pure and Mixed Metal Halide Perovskites Parameterized from First-Principles

  1. Seijas-Bellido, J.A.
  2. Samanta, B.
  3. Valadez-Villalobos, K.
  4. Gallardo, J.J.
  5. Navas, J.
  6. Balestra, S.R.G.
  7. Madero Castro, R.M.
  8. Vicent-Luna, J.M.
  9. Tao, S.
  10. Toroker, M.C.
  11. Anta, J.A.
Journal:
Journal of Chemical Information and Modeling

ISSN: 1549-960X,  1549-9596

Year of publication: 2022

Volume: 62

Issue: 24

Pages: 6423-6435

Type: Article

DOI: 10.1021/ACS.JCIM.1C01506 GOOGLE SCHOLAR lock_openOpen access editor

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Data source: Scopus