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Filtros : "ESTRUTURA ELETRÔNICA" "Estados Unidos" Removido: "2023" Limpar

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  • Artigo de periodico

    Permutationally restrained diabatization by machine intelligence (2021)

    Shu, Yinan; Varga, Zoltan; Oliveira Filho, Antonio Gustavo Sampaio de ; Truhlar, Donald G.

    Source: Journal of Chemical Theory and Computation. Unidade: FFCLRP

    Subjects: APRENDIZADO COMPUTACIONAL, ESTRUTURA ELETRÔNICA, QUÍMICA TEÓRICA, ACOPLAGEM

    Acesso à fonteDOIHow to cite
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    • ABNT

      SHU, Yinan et al. Permutationally restrained diabatization by machine intelligence. Journal of Chemical Theory and Computation, v. 17, n. 2, p. 1106-1116, 2021Tradução . . Disponível em: https://doi.org/10.1021/acs.jctc.0c01110. Acesso em: 08 nov. 2025.

    • APA

      Shu, Y., Varga, Z., Oliveira Filho, A. G. S. de, & Truhlar, D. G. (2021). Permutationally restrained diabatization by machine intelligence. Journal of Chemical Theory and Computation, 17( 2), 1106-1116. doi:10.1021/acs.jctc.0c01110

    • NLM

      Shu Y, Varga Z, Oliveira Filho AGS de, Truhlar DG. Permutationally restrained diabatization by machine intelligence [Internet]. Journal of Chemical Theory and Computation. 2021 ; 17( 2): 1106-1116.[citado 2025 nov. 08 ] Available from: https://doi.org/10.1021/acs.jctc.0c01110

    • Vancouver

      Shu Y, Varga Z, Oliveira Filho AGS de, Truhlar DG. Permutationally restrained diabatization by machine intelligence [Internet]. Journal of Chemical Theory and Computation. 2021 ; 17( 2): 1106-1116.[citado 2025 nov. 08 ] Available from: https://doi.org/10.1021/acs.jctc.0c01110

  • Artigo de periodico

    The structure of liquid alkali nitrates and nitrites (2017)

    Wilding, Martin C; Wilson, Mark; Ribeiro, Mauro Carlos Costa ; Benmore, Chris J; Weber, J. K. R; Alderman, O. L. G; Tamalonis, Anthony; Parise, J. B

    Source: Physical Chemistry Chemical Physics. Unidade: IQ

    Subjects: NITRATOS, DIFRAÇÃO POR RAIOS X, ESTRUTURA ELETRÔNICA

    Acesso à fonteDOIHow to cite
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    • ABNT

      WILDING, Martin C et al. The structure of liquid alkali nitrates and nitrites. Physical Chemistry Chemical Physics, v. 19, n. 32, p. 21625-21638, 2017Tradução . . Disponível em: https://doi.org/10.1039/c7cp03465b. Acesso em: 08 nov. 2025.

    • APA

      Wilding, M. C., Wilson, M., Ribeiro, M. C. C., Benmore, C. J., Weber, J. K. R., Alderman, O. L. G., et al. (2017). The structure of liquid alkali nitrates and nitrites. Physical Chemistry Chemical Physics, 19( 32), 21625-21638. doi:10.1039/c7cp03465b

    • NLM

      Wilding MC, Wilson M, Ribeiro MCC, Benmore CJ, Weber JKR, Alderman OLG, Tamalonis A, Parise JB. The structure of liquid alkali nitrates and nitrites [Internet]. Physical Chemistry Chemical Physics. 2017 ; 19( 32): 21625-21638.[citado 2025 nov. 08 ] Available from: https://doi.org/10.1039/c7cp03465b

    • Vancouver

      Wilding MC, Wilson M, Ribeiro MCC, Benmore CJ, Weber JKR, Alderman OLG, Tamalonis A, Parise JB. The structure of liquid alkali nitrates and nitrites [Internet]. Physical Chemistry Chemical Physics. 2017 ; 19( 32): 21625-21638.[citado 2025 nov. 08 ] Available from: https://doi.org/10.1039/c7cp03465b

  • Artigo de periodico

    Spectroscopy and electronic structure of 'SR' IND.2''Y''RU''O' IND. 6' and 'SR' IND. 2''Y''RU' IND. 0.75''IR' IND. 0.25''O' IND. 6' (2016)

    Guedes, E. B.; Abbate, M.; Mossanek, R. J. O.; Vicentin, F. C.; Abud, Fábio Santos Alves ; Jardim, Renato de Figueiredo

    Source: PHYSICAL REVIEW B. Unidade: IF

    Subjects: ESPECTROSCOPIA, ESTRUTURA ELETRÔNICA

    Versão PublicadaAcesso à fonteDOIHow to cite
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    • ABNT

      GUEDES, E. B. et al. Spectroscopy and electronic structure of 'SR' IND.2''Y''RU''O' IND. 6' and 'SR' IND. 2''Y''RU' IND. 0.75''IR' IND. 0.25''O' IND. 6'. PHYSICAL REVIEW B, v. 94, n. 4, p. 045109, 2016Tradução . . Disponível em: https://doi.org/10.1103/PhysRevB.94.045109. Acesso em: 08 nov. 2025.

    • APA

      Guedes, E. B., Abbate, M., Mossanek, R. J. O., Vicentin, F. C., Abud, F. S. A., & Jardim, R. de F. (2016). Spectroscopy and electronic structure of 'SR' IND.2''Y''RU''O' IND. 6' and 'SR' IND. 2''Y''RU' IND. 0.75''IR' IND. 0.25''O' IND. 6'. PHYSICAL REVIEW B, 94( 4), 045109. doi:10.1103/PhysRevB.94.045109

    • NLM

      Guedes EB, Abbate M, Mossanek RJO, Vicentin FC, Abud FSA, Jardim R de F. Spectroscopy and electronic structure of 'SR' IND.2''Y''RU''O' IND. 6' and 'SR' IND. 2''Y''RU' IND. 0.75''IR' IND. 0.25''O' IND. 6' [Internet]. PHYSICAL REVIEW B. 2016 ; 94( 4): 045109.[citado 2025 nov. 08 ] Available from: https://doi.org/10.1103/PhysRevB.94.045109

    • Vancouver

      Guedes EB, Abbate M, Mossanek RJO, Vicentin FC, Abud FSA, Jardim R de F. Spectroscopy and electronic structure of 'SR' IND.2''Y''RU''O' IND. 6' and 'SR' IND. 2''Y''RU' IND. 0.75''IR' IND. 0.25''O' IND. 6' [Internet]. PHYSICAL REVIEW B. 2016 ; 94( 4): 045109.[citado 2025 nov. 08 ] Available from: https://doi.org/10.1103/PhysRevB.94.045109
  • 1

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