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Filtros : "GALEMBECK, SERGIO EMANUEL" "2018" Removido: "International Journal of Quantum Chemistry" Limpar

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  • Artigo de periodico

    Use of density functional based tight binding methods in vibrational circular dichroism (2018)

    Teodoro, Tiago Quevedo ; Koenis, M. A. J.; Rüger, R.; Galembeck, Sérgio Emanuel ; Buma, W. J.; Nicu, V. P.; Visscher, Lucas

    Source: The Journal of Physical Chemistry A. Unidade: FFCLRP

    Subjects: ESPECTROMETRIA, QUÍMICA QUÂNTICA

    Acesso à fonteDOIHow to cite
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    • ABNT

      TEODORO, Tiago Quevedo et al. Use of density functional based tight binding methods in vibrational circular dichroism. The Journal of Physical Chemistry A, v. 122, n. 49, p. 9435-9445, 2018Tradução . . Disponível em: https://doi.org/10.1021/acs.jpca.8b08218. Acesso em: 28 nov. 2025.

    • APA

      Teodoro, T. Q., Koenis, M. A. J., Rüger, R., Galembeck, S. E., Buma, W. J., Nicu, V. P., & Visscher, L. (2018). Use of density functional based tight binding methods in vibrational circular dichroism. The Journal of Physical Chemistry A, 122( 49), 9435-9445. doi:10.1021/acs.jpca.8b08218

    • NLM

      Teodoro TQ, Koenis MAJ, Rüger R, Galembeck SE, Buma WJ, Nicu VP, Visscher L. Use of density functional based tight binding methods in vibrational circular dichroism [Internet]. The Journal of Physical Chemistry A. 2018 ; 122( 49): 9435-9445.[citado 2025 nov. 28 ] Available from: https://doi.org/10.1021/acs.jpca.8b08218

    • Vancouver

      Teodoro TQ, Koenis MAJ, Rüger R, Galembeck SE, Buma WJ, Nicu VP, Visscher L. Use of density functional based tight binding methods in vibrational circular dichroism [Internet]. The Journal of Physical Chemistry A. 2018 ; 122( 49): 9435-9445.[citado 2025 nov. 28 ] Available from: https://doi.org/10.1021/acs.jpca.8b08218

  • Artigo de periodico

    How does the total charge and isomerism influence the Ru–NO ammine complexes? (2018)

    Orenha, Renato Pereira ; Tfouni, Elia ; Galembeck, Sérgio Emanuel

    Source: Physical Chemistry Chemical Physics. Unidade: FFCLRP

    Subjects: QUÍMICA ORGÂNICA, RUTÊNIO, ÓXIDO NÍTRICO

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    • ABNT

      ORENHA, Renato Pereira e TFOUNI, Elia e GALEMBECK, Sérgio Emanuel. How does the total charge and isomerism influence the Ru–NO ammine complexes?. Physical Chemistry Chemical Physics, v. 20, n. 19, p. 13348-13356, 2018Tradução . . Disponível em: https://doi.org/10.1039/c8cp00865e. Acesso em: 28 nov. 2025.

    • APA

      Orenha, R. P., Tfouni, E., & Galembeck, S. E. (2018). How does the total charge and isomerism influence the Ru–NO ammine complexes? Physical Chemistry Chemical Physics, 20( 19), 13348-13356. doi:10.1039/c8cp00865e

    • NLM

      Orenha RP, Tfouni E, Galembeck SE. How does the total charge and isomerism influence the Ru–NO ammine complexes? [Internet]. Physical Chemistry Chemical Physics. 2018 ; 20( 19): 13348-13356.[citado 2025 nov. 28 ] Available from: https://doi.org/10.1039/c8cp00865e

    • Vancouver

      Orenha RP, Tfouni E, Galembeck SE. How does the total charge and isomerism influence the Ru–NO ammine complexes? [Internet]. Physical Chemistry Chemical Physics. 2018 ; 20( 19): 13348-13356.[citado 2025 nov. 28 ] Available from: https://doi.org/10.1039/c8cp00865e

  • Artigo de periodico

    The influence of the negative hyperconjugation is relevant for the analysis of the π-π* conjugation with the mono-substitution and di-substitution of H2C= by O= and/or HN= in trans-buta-1,3-diene ? (2018)

    Orenha, Renato Pereira ; Vessecchi, Ricardo ; Galembeck, Sérgio Emanuel

    Source: Structural Chemistry. Unidade: FFCLRP

    Subjects: QUÍMICA ORGÂNICA, MODELAGEM MOLECULAR

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      ORENHA, Renato Pereira e VESSECCHI, Ricardo e GALEMBECK, Sérgio Emanuel. The influence of the negative hyperconjugation is relevant for the analysis of the π-π* conjugation with the mono-substitution and di-substitution of H2C= by O= and/or HN= in trans-buta-1,3-diene ?. Structural Chemistry, v. 29, n. 3, p. 847-857, 2018Tradução . . Disponível em: https://doi.org/10.1007/s11224-017-1070-4. Acesso em: 28 nov. 2025.

    • APA

      Orenha, R. P., Vessecchi, R., & Galembeck, S. E. (2018). The influence of the negative hyperconjugation is relevant for the analysis of the π-π* conjugation with the mono-substitution and di-substitution of H2C= by O= and/or HN= in trans-buta-1,3-diene ? Structural Chemistry, 29( 3), 847-857. doi:10.1007/s11224-017-1070-4

    • NLM

      Orenha RP, Vessecchi R, Galembeck SE. The influence of the negative hyperconjugation is relevant for the analysis of the π-π* conjugation with the mono-substitution and di-substitution of H2C= by O= and/or HN= in trans-buta-1,3-diene ? [Internet]. Structural Chemistry. 2018 ; 29( 3): 847-857.[citado 2025 nov. 28 ] Available from: https://doi.org/10.1007/s11224-017-1070-4

    • Vancouver

      Orenha RP, Vessecchi R, Galembeck SE. The influence of the negative hyperconjugation is relevant for the analysis of the π-π* conjugation with the mono-substitution and di-substitution of H2C= by O= and/or HN= in trans-buta-1,3-diene ? [Internet]. Structural Chemistry. 2018 ; 29( 3): 847-857.[citado 2025 nov. 28 ] Available from: https://doi.org/10.1007/s11224-017-1070-4

  • Artigo de periodico

    Frequency range selection method for vibrational spectra (2018)

    Teodoro, Tiago Quevedo ; Koenis, M. A. J.; Galembeck, Sérgio Emanuel ; Nicu, V. P.; Buma, W. J.; Visscher, Lucas

    Source: The Journal of Physical Chemistry Letters. Unidade: FFCLRP

    Subjects: ESPECTROMETRIA, FÍSICO-QUÍMICA

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    • ABNT

      TEODORO, Tiago Quevedo et al. Frequency range selection method for vibrational spectra. The Journal of Physical Chemistry Letters, v. 9, n. 23, p. 6878-6882, 2018Tradução . . Disponível em: https://doi.org/10.1021/acs.jpclett.8b02963. Acesso em: 28 nov. 2025.

    • APA

      Teodoro, T. Q., Koenis, M. A. J., Galembeck, S. E., Nicu, V. P., Buma, W. J., & Visscher, L. (2018). Frequency range selection method for vibrational spectra. The Journal of Physical Chemistry Letters, 9( 23), 6878-6882. doi:10.1021/acs.jpclett.8b02963

    • NLM

      Teodoro TQ, Koenis MAJ, Galembeck SE, Nicu VP, Buma WJ, Visscher L. Frequency range selection method for vibrational spectra [Internet]. The Journal of Physical Chemistry Letters. 2018 ; 9( 23): 6878-6882.[citado 2025 nov. 28 ] Available from: https://doi.org/10.1021/acs.jpclett.8b02963

    • Vancouver

      Teodoro TQ, Koenis MAJ, Galembeck SE, Nicu VP, Buma WJ, Visscher L. Frequency range selection method for vibrational spectra [Internet]. The Journal of Physical Chemistry Letters. 2018 ; 9( 23): 6878-6882.[citado 2025 nov. 28 ] Available from: https://doi.org/10.1021/acs.jpclett.8b02963
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