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Artigo de periodico
The Importance of the Density Functional Theory Exchange−Correlation Hartree−Fock Term in Magnetic Resonance: Application to an Aqueous Environment (2023)
Provasi, Patricio F; Costa, Lucas Modesto da; Sampaio, Felipe; Silva, Tércio; Andrade-Filho, Tarciso; Cunha, Antonio Rodrigues da ; Gester, Rodrigo
Source: The Journal of Physical Chemistry A. Unidade: IF
Assunto: RESSONÂNCIA MAGNÉTICA
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ABNT
PROVASI, Patricio F et al. The Importance of the Density Functional Theory Exchange−Correlation Hartree−Fock Term in Magnetic Resonance: Application to an Aqueous Environment. The Journal of Physical Chemistry A, v. 127, n. 3, p. 619–626, 2023Tradução . . Disponível em: https://doi.org/10.1021/acs.jpca.2c05623. Acesso em: 28 abr. 2024.
APA
Provasi, P. F., Costa, L. M. da, Sampaio, F., Silva, T., Andrade-Filho, T., Cunha, A. R. da, & Gester, R. (2023). The Importance of the Density Functional Theory Exchange−Correlation Hartree−Fock Term in Magnetic Resonance: Application to an Aqueous Environment. The Journal of Physical Chemistry A, 127( 3), 619–626. doi:10.1021/acs.jpca.2c05623
NLM
Provasi PF, Costa LM da, Sampaio F, Silva T, Andrade-Filho T, Cunha AR da, Gester R. The Importance of the Density Functional Theory Exchange−Correlation Hartree−Fock Term in Magnetic Resonance: Application to an Aqueous Environment [Internet]. The Journal of Physical Chemistry A. 2023 ; 127( 3): 619–626.[citado 2024 abr. 28 ] Available from: https://doi.org/10.1021/acs.jpca.2c05623
Vancouver
Provasi PF, Costa LM da, Sampaio F, Silva T, Andrade-Filho T, Cunha AR da, Gester R. The Importance of the Density Functional Theory Exchange−Correlation Hartree−Fock Term in Magnetic Resonance: Application to an Aqueous Environment [Internet]. The Journal of Physical Chemistry A. 2023 ; 127( 3): 619–626.[citado 2024 abr. 28 ] Available from: https://doi.org/10.1021/acs.jpca.2c05623
Artigo de periodico
Theoretical analysis of the influence of C–H⋯ O bonds on the NMR constants of uracil in DMSO (2020)
Gester, Rodrigo; Carrano, Ramiro S. Galeano; Provasi, Patricio F; Bistafa, Carlos; Canuto, Sylvio Roberto Accioly
Source: Theoretical Chemistry Accounts. Unidade: IF
Assunto: RESSONÂNCIA MAGNÉTICA NUCLEAR
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
GESTER, Rodrigo et al. Theoretical analysis of the influence of C–H⋯ O bonds on the NMR constants of uracil in DMSO. Theoretical Chemistry Accounts, v. 139, 2020Tradução . . Disponível em: https://doi.org/10.1007/s00214-020-02670-4. Acesso em: 28 abr. 2024.
APA
Gester, R., Carrano, R. S. G., Provasi, P. F., Bistafa, C., & Canuto, S. R. A. (2020). Theoretical analysis of the influence of C–H⋯ O bonds on the NMR constants of uracil in DMSO. Theoretical Chemistry Accounts, 139. doi:10.1007/s00214-020-02670-4
NLM
Gester R, Carrano RSG, Provasi PF, Bistafa C, Canuto SRA. Theoretical analysis of the influence of C–H⋯ O bonds on the NMR constants of uracil in DMSO [Internet]. Theoretical Chemistry Accounts. 2020 ; 139[citado 2024 abr. 28 ] Available from: https://doi.org/10.1007/s00214-020-02670-4
Vancouver
Gester R, Carrano RSG, Provasi PF, Bistafa C, Canuto SRA. Theoretical analysis of the influence of C–H⋯ O bonds on the NMR constants of uracil in DMSO [Internet]. Theoretical Chemistry Accounts. 2020 ; 139[citado 2024 abr. 28 ] Available from: https://doi.org/10.1007/s00214-020-02670-4
Artigo de periodico
Monte carlo–quantum mechanics study of magnetic properties of hydrogen peroxide in liquid water (2014)
Cristina Caputo, Maria; Provasi, Patricio F; Benitez, Lucia; Georg, Herbert C.; Coutinho, Kaline Rabelo ; Canuto, Sylvio Roberto Accioly
Source: JOURNAL OF PHYSICAL CHEMISTRY A. Unidade: IF
Subjects: SPIN, MÉTODO DE MONTE CARLO
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ABNT
CRISTINA CAPUTO, Maria et al. Monte carlo–quantum mechanics study of magnetic properties of hydrogen peroxide in liquid water. JOURNAL OF PHYSICAL CHEMISTRY A, v. 118, n. 32, p. 6239-6247, 2014Tradução . . Disponível em: https://doi.org/10.1021/jp411303n. Acesso em: 28 abr. 2024.
APA
Cristina Caputo, M., Provasi, P. F., Benitez, L., Georg, H. C., Coutinho, K. R., & Canuto, S. R. A. (2014). Monte carlo–quantum mechanics study of magnetic properties of hydrogen peroxide in liquid water. JOURNAL OF PHYSICAL CHEMISTRY A, 118( 32), 6239-6247. doi:10.1021/jp411303n
NLM
Cristina Caputo M, Provasi PF, Benitez L, Georg HC, Coutinho KR, Canuto SRA. Monte carlo–quantum mechanics study of magnetic properties of hydrogen peroxide in liquid water [Internet]. JOURNAL OF PHYSICAL CHEMISTRY A. 2014 ; 118( 32): 6239-6247.[citado 2024 abr. 28 ] Available from: https://doi.org/10.1021/jp411303n
Vancouver
Cristina Caputo M, Provasi PF, Benitez L, Georg HC, Coutinho KR, Canuto SRA. Monte carlo–quantum mechanics study of magnetic properties of hydrogen peroxide in liquid water [Internet]. JOURNAL OF PHYSICAL CHEMISTRY A. 2014 ; 118( 32): 6239-6247.[citado 2024 abr. 28 ] Available from: https://doi.org/10.1021/jp411303n
Artigo de periodico
A simple analysis of the influence of the solvent-induced electronic polarization on the 'ANTPOT. 15'N' magnetic shielding of pyridine in water (2012)
Gester, Rodrigo M ; Georg, • Herbert C; Fonseca, Tertius L; Provasi, Patricio F; Canuto, Sylvio
Source: THEORETICAL CHEMISTRY ACCOUNTS: THEORY, COMPUTATION, AND MODELING (THEORETICA CHIMICA ACTA). Unidade: IF
Subjects: POLARIZAÇÃO, MAGNETISMO
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
GESTER, Rodrigo M et al. A simple analysis of the influence of the solvent-induced electronic polarization on the 'ANTPOT. 15'N' magnetic shielding of pyridine in water. THEORETICAL CHEMISTRY ACCOUNTS: THEORY, COMPUTATION, AND MODELING (THEORETICA CHIMICA ACTA), v. 131, n. 5, p. 1220, 2012Tradução . . Disponível em: https://doi.org/10.1007/978-3-642-41163-2_11. Acesso em: 28 abr. 2024.
APA
Gester, R. M., Georg, • H. C., Fonseca, T. L., Provasi, P. F., & Canuto, S. (2012). A simple analysis of the influence of the solvent-induced electronic polarization on the 'ANTPOT. 15'N' magnetic shielding of pyridine in water. THEORETICAL CHEMISTRY ACCOUNTS: THEORY, COMPUTATION, AND MODELING (THEORETICA CHIMICA ACTA), 131( 5), 1220. doi:10.1007/978-3-642-41163-2_11
NLM
Gester RM, Georg • HC, Fonseca TL, Provasi PF, Canuto S. A simple analysis of the influence of the solvent-induced electronic polarization on the 'ANTPOT. 15'N' magnetic shielding of pyridine in water [Internet]. THEORETICAL CHEMISTRY ACCOUNTS: THEORY, COMPUTATION, AND MODELING (THEORETICA CHIMICA ACTA). 2012 ;131( 5): 1220.[citado 2024 abr. 28 ] Available from: https://doi.org/10.1007/978-3-642-41163-2_11
Vancouver
Gester RM, Georg • HC, Fonseca TL, Provasi PF, Canuto S. A simple analysis of the influence of the solvent-induced electronic polarization on the 'ANTPOT. 15'N' magnetic shielding of pyridine in water [Internet]. THEORETICAL CHEMISTRY ACCOUNTS: THEORY, COMPUTATION, AND MODELING (THEORETICA CHIMICA ACTA). 2012 ;131( 5): 1220.[citado 2024 abr. 28 ] Available from: https://doi.org/10.1007/978-3-642-41163-2_11
Trabalho de evento-resumo
NMR properties of liquid ammonia (2009)
Gester, Rodrigo M; Canuto, Sylvio; Georg, Herbert C; Caputo, Cristina; Provasi, Patricio F
Source: Resumo. Conference titles: Encontro Nacional de Física da Matéria Condensada. Unidade: IF
Subjects: FÍSICA DA MATÉRIA CONDENSADA, FÍSICO-QUÍMICA, RESSONÂNCIA MAGNÉTICA NUCLEAR
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
GESTER, Rodrigo M et al. NMR properties of liquid ammonia. 2009, Anais.. São Paulo: SBF, 2009. Disponível em: http://www.sbf1.sbfisica.org.br/eventos/enfmc/xxxii/sys/resumos/R0078-1.pdf. Acesso em: 28 abr. 2024.
APA
Gester, R. M., Canuto, S., Georg, H. C., Caputo, C., & Provasi, P. F. (2009). NMR properties of liquid ammonia. In Resumo. São Paulo: SBF. Recuperado de http://www.sbf1.sbfisica.org.br/eventos/enfmc/xxxii/sys/resumos/R0078-1.pdf
NLM
Gester RM, Canuto S, Georg HC, Caputo C, Provasi PF. NMR properties of liquid ammonia [Internet]. Resumo. 2009 ;[citado 2024 abr. 28 ] Available from: http://www.sbf1.sbfisica.org.br/eventos/enfmc/xxxii/sys/resumos/R0078-1.pdf
Vancouver
Gester RM, Canuto S, Georg HC, Caputo C, Provasi PF. NMR properties of liquid ammonia [Internet]. Resumo. 2009 ;[citado 2024 abr. 28 ] Available from: http://www.sbf1.sbfisica.org.br/eventos/enfmc/xxxii/sys/resumos/R0078-1.pdf

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