• Media type: E-Article
  • Title: Efficient Computation of Structural and Electronic Properties of Halide Perovskites Using Density Functional Tight Binding: GFN1-xTB Method
  • Contributor: Vicent-Luna, José Manuel; Apergi, Sofia; Tao, Shuxia
  • Published: American Chemical Society (ACS), 2021
  • Published in: Journal of Chemical Information and Modeling, 61 (2021) 9, Seite 4415-4424
  • Language: English
  • DOI: 10.1021/acs.jcim.1c00432
  • ISSN: 1549-9596; 1549-960X
  • Origination:
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