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Filtros : "Ducati, Lucas Colucci" "MOLÉCULA" Limpar

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  • Artigo de periodico

    Inquiring 199Hg NMR Parameters by Combining Ab Initio Molecular Dynamics and Relativistic NMR Calculations (2024)

    Schenberg, Leonardo Araujo ; Ducati, Lucas Colucci ; Autschbach, Jochen

    Source: Inorganic Chemistry. Unidade: IQ

    Subjects: RESSONÂNCIA MAGNÉTICA NUCLEAR, MERCÚRIO (ELEMENTO QUÍMICO), MOLÉCULA, SOLVENTE

    Acesso à fonteDOIHow to cite
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    • ABNT

      SCHENBERG, Leonardo Araujo e DUCATI, Lucas Colucci e AUTSCHBACH, Jochen. Inquiring 199Hg NMR Parameters by Combining Ab Initio Molecular Dynamics and Relativistic NMR Calculations. Inorganic Chemistry, v. 63, p. 2082−2089, 2024Tradução . . Disponível em: https://dx.doi.org/10.1021/acs.inorgchem.3c03878. Acesso em: 02 out. 2024.

    • APA

      Schenberg, L. A., Ducati, L. C., & Autschbach, J. (2024). Inquiring 199Hg NMR Parameters by Combining Ab Initio Molecular Dynamics and Relativistic NMR Calculations. Inorganic Chemistry, 63, 2082−2089. doi:10.1021/acs.inorgchem.3c03878

    • NLM

      Schenberg LA, Ducati LC, Autschbach J. Inquiring 199Hg NMR Parameters by Combining Ab Initio Molecular Dynamics and Relativistic NMR Calculations [Internet]. Inorganic Chemistry. 2024 ; 63 2082−2089.[citado 2024 out. 02 ] Available from: https://dx.doi.org/10.1021/acs.inorgchem.3c03878

    • Vancouver

      Schenberg LA, Ducati LC, Autschbach J. Inquiring 199Hg NMR Parameters by Combining Ab Initio Molecular Dynamics and Relativistic NMR Calculations [Internet]. Inorganic Chemistry. 2024 ; 63 2082−2089.[citado 2024 out. 02 ] Available from: https://dx.doi.org/10.1021/acs.inorgchem.3c03878

  • Artigo de periodico

    Analyzing the N–H+…π interactions of protonated tryptophan and phenylalkylamines using QTAIM, NCI, and NBO (2020)

    Oliveira, Andre F. Rodrigues ; Batista, Patrick Rodrigues ; Ducati, Lucas Colucci ; Correra, Thiago Carita

    Source: Theoretical Chemistry Accounts. Unidade: IQ

    Subjects: INTERAÇÃO QUÍMICA, MOLÉCULA

    Acesso à fonteDOIHow to cite
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    • ABNT

      OLIVEIRA, Andre F. Rodrigues et al. Analyzing the N–H+…π interactions of protonated tryptophan and phenylalkylamines using QTAIM, NCI, and NBO. Theoretical Chemistry Accounts, v. 139, p. 1-9 art. 130, 2020Tradução . . Disponível em: https://doi.org/10.1007/s00214-020-02643-7. Acesso em: 02 out. 2024.

    • APA

      Oliveira, A. F. R., Batista, P. R., Ducati, L. C., & Correra, T. C. (2020). Analyzing the N–H+…π interactions of protonated tryptophan and phenylalkylamines using QTAIM, NCI, and NBO. Theoretical Chemistry Accounts, 139, 1-9 art. 130. doi:10.1007/s00214-020-02643-7

    • NLM

      Oliveira AFR, Batista PR, Ducati LC, Correra TC. Analyzing the N–H+…π interactions of protonated tryptophan and phenylalkylamines using QTAIM, NCI, and NBO [Internet]. Theoretical Chemistry Accounts. 2020 ; 139 1-9 art. 130.[citado 2024 out. 02 ] Available from: https://doi.org/10.1007/s00214-020-02643-7

    • Vancouver

      Oliveira AFR, Batista PR, Ducati LC, Correra TC. Analyzing the N–H+…π interactions of protonated tryptophan and phenylalkylamines using QTAIM, NCI, and NBO [Internet]. Theoretical Chemistry Accounts. 2020 ; 139 1-9 art. 130.[citado 2024 out. 02 ] Available from: https://doi.org/10.1007/s00214-020-02643-7
  • 1

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