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Artigo de periodico
On a direct method of calculating pressure in the canonical ensemble (2024)
Tanouye, Fernando Takeshi ; Alves, Jozismar Rodrigues
Source: Journal of Chemical Physics. Unidade: IF
Assunto: MÉTODO DE MONTE CARLO
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TANOUYE, Fernando Takeshi e ALVES, Jozismar Rodrigues. On a direct method of calculating pressure in the canonical ensemble. Journal of Chemical Physics, v. 160, n. 6, 2024Tradução . . Disponível em: https://doi.org/10.1063/5.0187585. Acesso em: 15 nov. 2024.
APA
Tanouye, F. T., & Alves, J. R. (2024). On a direct method of calculating pressure in the canonical ensemble. Journal of Chemical Physics, 160( 6). doi:10.1063/5.0187585
NLM
Tanouye FT, Alves JR. On a direct method of calculating pressure in the canonical ensemble [Internet]. Journal of Chemical Physics. 2024 ; 160( 6):[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/5.0187585
Vancouver
Tanouye FT, Alves JR. On a direct method of calculating pressure in the canonical ensemble [Internet]. Journal of Chemical Physics. 2024 ; 160( 6):[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/5.0187585
Artigo de periodico
Toward a numerically efficient description of bulk-solvated anionic states (2024)
Kiataki, Matheus Bacigalupo ; Coutinho, Kaline Rabelo ; Varella, Márcio Teixeira do Nascimento
Source: Journal of Chemical Physics. Unidade: IF
Assunto: MECÂNICA QUÂNTICA
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KIATAKI, Matheus Bacigalupo e COUTINHO, Kaline Rabelo e VARELLA, Márcio Teixeira do Nascimento. Toward a numerically efficient description of bulk-solvated anionic states. Journal of Chemical Physics, v. 161, n. 3, 2024Tradução . . Disponível em: https://doi.org/10.1063/5.0203247. Acesso em: 15 nov. 2024.
APA
Kiataki, M. B., Coutinho, K. R., & Varella, M. T. do N. (2024). Toward a numerically efficient description of bulk-solvated anionic states. Journal of Chemical Physics, 161( 3). doi:https://doi.org/10.1063/5.0203247
NLM
Kiataki MB, Coutinho KR, Varella MT do N. Toward a numerically efficient description of bulk-solvated anionic states [Internet]. Journal of Chemical Physics. 2024 ; 161( 3):[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/5.0203247
Vancouver
Kiataki MB, Coutinho KR, Varella MT do N. Toward a numerically efficient description of bulk-solvated anionic states [Internet]. Journal of Chemical Physics. 2024 ; 161( 3):[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/5.0203247
Artigo de periodico
Applicability of DFT functionals for evaluating the first hyperpolarizability of phenol blue in solution (2021)
Brandao, Idney ; Fonseca, Tertius ; Franco, Leandro ; Georg, Herbert C. ; Castro, Marcos
Source: Journal of Chemical Physics. Unidade: IF
Subjects: FÍSICO-QUÍMICA, SOLVENTE, MECÂNICA QUÂNTICA
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BRANDAO, Idney et al. Applicability of DFT functionals for evaluating the first hyperpolarizability of phenol blue in solution. Journal of Chemical Physics, v. 154, n. 9, 2021Tradução . . Disponível em: https://doi.org/10.1063/5.0033134. Acesso em: 15 nov. 2024.
APA
Brandao, I., Fonseca, T., Franco, L., Georg, H. C., & Castro, M. (2021). Applicability of DFT functionals for evaluating the first hyperpolarizability of phenol blue in solution. Journal of Chemical Physics, 154( 9). doi:10.1063/5.0033134
NLM
Brandao I, Fonseca T, Franco L, Georg HC, Castro M. Applicability of DFT functionals for evaluating the first hyperpolarizability of phenol blue in solution [Internet]. Journal of Chemical Physics. 2021 ; 154( 9):[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/5.0033134
Vancouver
Brandao I, Fonseca T, Franco L, Georg HC, Castro M. Applicability of DFT functionals for evaluating the first hyperpolarizability of phenol blue in solution [Internet]. Journal of Chemical Physics. 2021 ; 154( 9):[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/5.0033134
Artigo de periodico
Preferential solvation and optical properties of eumelanin building blocks in binary mixture of methanol and water (2021)
Oliveira, Leonardo Bruno Assis ; Fonseca, Tertius Lima ; Cabral, Benedito J C; Coutinho, Kaline Rabelo ; Canuto, Sylvio Roberto Accioly
Source: Journal of Chemical Physics. Unidade: IF
Subjects: SOLVATAÇÃO, ÁGUA, METANOL
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OLIVEIRA, Leonardo Bruno Assis et al. Preferential solvation and optical properties of eumelanin building blocks in binary mixture of methanol and water. Journal of Chemical Physics, v. 155, 2021Tradução . . Disponível em: https://doi.org/10.1063/5.0065723. Acesso em: 15 nov. 2024.
APA
Oliveira, L. B. A., Fonseca, T. L., Cabral, B. J. C., Coutinho, K. R., & Canuto, S. R. A. (2021). Preferential solvation and optical properties of eumelanin building blocks in binary mixture of methanol and water. Journal of Chemical Physics, 155. doi:10.1063/5.0065723
NLM
Oliveira LBA, Fonseca TL, Cabral BJC, Coutinho KR, Canuto SRA. Preferential solvation and optical properties of eumelanin building blocks in binary mixture of methanol and water [Internet]. Journal of Chemical Physics. 2021 ; 155[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/5.0065723
Vancouver
Oliveira LBA, Fonseca TL, Cabral BJC, Coutinho KR, Canuto SRA. Preferential solvation and optical properties of eumelanin building blocks in binary mixture of methanol and water [Internet]. Journal of Chemical Physics. 2021 ; 155[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/5.0065723
Artigo de periodico
On-the-fly dynamics simulations of transient anions (2019)
Kossoski, Fábris ; Varella, Marcio ; Barbatti, Mario
Source: Journal of Chemical Physics. Unidade: IF
Subjects: FÍSICO-QUÍMICA, COLISÕES DE ÍONS PESADOS RELATIVÍSTICOS, ESPALHAMENTO, ESPECTROSCOPIA ATÔMICA
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KOSSOSKI, Fábris e VARELLA, Marcio e BARBATTI, Mario. On-the-fly dynamics simulations of transient anions. Journal of Chemical Physics, v. 151, n. 22, 2019Tradução . . Disponível em: https://doi.org/10.1063/1.5130547. Acesso em: 15 nov. 2024.
APA
Kossoski, F., Varella, M., & Barbatti, M. (2019). On-the-fly dynamics simulations of transient anions. Journal of Chemical Physics, 151( 22). doi:10.1063/1.5130547
NLM
Kossoski F, Varella M, Barbatti M. On-the-fly dynamics simulations of transient anions [Internet]. Journal of Chemical Physics. 2019 ; 151( 22):[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/1.5130547
Vancouver
Kossoski F, Varella M, Barbatti M. On-the-fly dynamics simulations of transient anions [Internet]. Journal of Chemical Physics. 2019 ; 151( 22):[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/1.5130547
Artigo de periodico
Electron-impact electronic-state excitation of para-benzoquinone (2018)
Jones, D. B.; Costa, R. F. da; Kossoski, F.; Bettega, M. H. F.; Brunger, M. J.; Lima, M. A. P.; Ferreira da Silva, F.; Limao-Vieira, P.; Garcia, G.; White, R. D.; Varella, Márcio Teixeira do Nascimento
Source: Journal of Chemical Physics. Unidade: IF
Subjects: FÍSICA MOLECULAR, ESPECTROMETRIA, ÍONS
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JONES, D. B. et al. Electron-impact electronic-state excitation of para-benzoquinone. Journal of Chemical Physics, v. 148, n. 12, p. 124312, 2018Tradução . . Disponível em: https://aip.scitation.org/doi/10.1063/1.5023494?af=R. Acesso em: 15 nov. 2024.
APA
Jones, D. B., Costa, R. F. da, Kossoski, F., Bettega, M. H. F., Brunger, M. J., Lima, M. A. P., et al. (2018). Electron-impact electronic-state excitation of para-benzoquinone. Journal of Chemical Physics, 148( 12), 124312. doi:10.1063/1.5023494
NLM
Jones DB, Costa RF da, Kossoski F, Bettega MHF, Brunger MJ, Lima MAP, Ferreira da Silva F, Limao-Vieira P, Garcia G, White RD, Varella MT do N. Electron-impact electronic-state excitation of para-benzoquinone [Internet]. Journal of Chemical Physics. 2018 ; 148( 12): 124312.[citado 2024 nov. 15 ] Available from: https://aip.scitation.org/doi/10.1063/1.5023494?af=R
Vancouver
Jones DB, Costa RF da, Kossoski F, Bettega MHF, Brunger MJ, Lima MAP, Ferreira da Silva F, Limao-Vieira P, Garcia G, White RD, Varella MT do N. Electron-impact electronic-state excitation of para-benzoquinone [Internet]. Journal of Chemical Physics. 2018 ; 148( 12): 124312.[citado 2024 nov. 15 ] Available from: https://aip.scitation.org/doi/10.1063/1.5023494?af=R
Artigo de periodico
Integral elastic, vibrational-excitation, electronic-state excitation, ionization, and total cross sections for electron scattering from para-benzoquinone (2018)
Jones, D. B.; Costa, R. F. da; Kossoski, F.; Bettega, M. H. F.; Brunger, M. J.; Lima, M. A. P.; Garcia, G.; White, R. D.; Blanco, F.; Varella, Márcio Teixeira do Nascimento
Source: Journal of Chemical Physics. Unidade: IF
Subjects: FÍSICA MOLECULAR, ESPECTROMETRIA, ÍONS
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JONES, D. B. et al. Integral elastic, vibrational-excitation, electronic-state excitation, ionization, and total cross sections for electron scattering from para-benzoquinone. Journal of Chemical Physics, v. 148, n. 20, p. 204305, 2018Tradução . . Disponível em: https://aip.scitation.org/doi/abs/10.1063/1.5028298. Acesso em: 15 nov. 2024.
APA
Jones, D. B., Costa, R. F. da, Kossoski, F., Bettega, M. H. F., Brunger, M. J., Lima, M. A. P., et al. (2018). Integral elastic, vibrational-excitation, electronic-state excitation, ionization, and total cross sections for electron scattering from para-benzoquinone. Journal of Chemical Physics, 148( 20), 204305. doi:10.1063/1.5028298
NLM
Jones DB, Costa RF da, Kossoski F, Bettega MHF, Brunger MJ, Lima MAP, Garcia G, White RD, Blanco F, Varella MT do N. Integral elastic, vibrational-excitation, electronic-state excitation, ionization, and total cross sections for electron scattering from para-benzoquinone [Internet]. Journal of Chemical Physics. 2018 ; 148( 20): 204305.[citado 2024 nov. 15 ] Available from: https://aip.scitation.org/doi/abs/10.1063/1.5028298
Vancouver
Jones DB, Costa RF da, Kossoski F, Bettega MHF, Brunger MJ, Lima MAP, Garcia G, White RD, Blanco F, Varella MT do N. Integral elastic, vibrational-excitation, electronic-state excitation, ionization, and total cross sections for electron scattering from para-benzoquinone [Internet]. Journal of Chemical Physics. 2018 ; 148( 20): 204305.[citado 2024 nov. 15 ] Available from: https://aip.scitation.org/doi/abs/10.1063/1.5028298
Artigo de periodico
An ab initio investigation for elastic and electronically inelastic electron scattering from para-benzoquinone (2018)
Costa, Júlio Cesar Ruivo ; Kossoski, F.; Bettega, M. H. F.; Jones, D. B.; Brunger, M. J.; Lima, M. A. P.; Ruivo, J. C.; Varella, Márcio Teixeira do Nascimento
Source: Journal of Chemical Physics. Unidade: IF
Subjects: FÍSICA MOLECULAR, ESPECTROMETRIA, ÍONS
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COSTA, Júlio Cesar Ruivo et al. An ab initio investigation for elastic and electronically inelastic electron scattering from para-benzoquinone. Journal of Chemical Physics, v. no 2019, n. 17, p. 174308, 2018Tradução . . Disponível em: https://aip.scitation.org/doi/10.1063/1.5050622. Acesso em: 15 nov. 2024.
APA
Costa, J. C. R., Kossoski, F., Bettega, M. H. F., Jones, D. B., Brunger, M. J., Lima, M. A. P., et al. (2018). An ab initio investigation for elastic and electronically inelastic electron scattering from para-benzoquinone. Journal of Chemical Physics, no 2019( 17), 174308. doi:10.1063/1.5050622
NLM
Costa JCR, Kossoski F, Bettega MHF, Jones DB, Brunger MJ, Lima MAP, Ruivo JC, Varella MT do N. An ab initio investigation for elastic and electronically inelastic electron scattering from para-benzoquinone [Internet]. Journal of Chemical Physics. 2018 ; no 2019( 17): 174308.[citado 2024 nov. 15 ] Available from: https://aip.scitation.org/doi/10.1063/1.5050622
Vancouver
Costa JCR, Kossoski F, Bettega MHF, Jones DB, Brunger MJ, Lima MAP, Ruivo JC, Varella MT do N. An ab initio investigation for elastic and electronically inelastic electron scattering from para-benzoquinone [Internet]. Journal of Chemical Physics. 2018 ; no 2019( 17): 174308.[citado 2024 nov. 15 ] Available from: https://aip.scitation.org/doi/10.1063/1.5050622
Artigo de periodico
Stochastic thermodynamics and entropy production of chemical reaction systems (2018)
Castro, Tânia Tomé Martins de; Oliveira, Mário José de
Source: Journal of Chemical Physics. Unidade: IF
Subjects: MECÂNICA ESTATÍSTICA QUÂNTICA, TERMODINÂMICA, PROCESSOS ESTOCÁSTICOS QUÂNTICOS
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CASTRO, Tânia Tomé Martins de e OLIVEIRA, Mário José de. Stochastic thermodynamics and entropy production of chemical reaction systems. Journal of Chemical Physics, v. 148, n. ju 2018, p. 224104, 2018Tradução . . Disponível em: https://doi.org/10.1063/1.5037045. Acesso em: 15 nov. 2024.
APA
Castro, T. T. M. de, & Oliveira, M. J. de. (2018). Stochastic thermodynamics and entropy production of chemical reaction systems. Journal of Chemical Physics, 148( ju 2018), 224104. doi:10.1063/1.5037045
NLM
Castro TTM de, Oliveira MJ de. Stochastic thermodynamics and entropy production of chemical reaction systems [Internet]. Journal of Chemical Physics. 2018 ; 148( ju 2018): 224104.[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/1.5037045
Vancouver
Castro TTM de, Oliveira MJ de. Stochastic thermodynamics and entropy production of chemical reaction systems [Internet]. Journal of Chemical Physics. 2018 ; 148( ju 2018): 224104.[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/1.5037045
Artigo de periodico
An experimental and theoretical investigation into the electronically excited states of para-benzoquinone (2017)
Jones, D. B.; Limao-Vieira, P.; Mendes, M.; Jones, N. C.; Hoffmann, S. V.; Costa, R. F. da; Bettega, M. H. F.; Blanco, F.; Garcia, G.; Ingolfsson, O.; Lima, M. A. P.; Brunger, M. J.; Varella, Márcio Teixeira do Nascimento
Source: Journal of Chemical Physics. Unidade: IF
Subjects: ESPECTROMETRIA, ÍONS
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JONES, D. B. et al. An experimental and theoretical investigation into the electronically excited states of para-benzoquinone. Journal of Chemical Physics, v. 146, n. 18, p. 184303, 2017Tradução . . Disponível em: https://aip.scitation.org/doi/10.1063/1.4982940. Acesso em: 15 nov. 2024.
APA
Jones, D. B., Limao-Vieira, P., Mendes, M., Jones, N. C., Hoffmann, S. V., Costa, R. F. da, et al. (2017). An experimental and theoretical investigation into the electronically excited states of para-benzoquinone. Journal of Chemical Physics, 146( 18), 184303. doi:10.1063/1.4982940
NLM
Jones DB, Limao-Vieira P, Mendes M, Jones NC, Hoffmann SV, Costa RF da, Bettega MHF, Blanco F, Garcia G, Ingolfsson O, Lima MAP, Brunger MJ, Varella MT do N. An experimental and theoretical investigation into the electronically excited states of para-benzoquinone [Internet]. Journal of Chemical Physics. 2017 ; 146( 18): 184303.[citado 2024 nov. 15 ] Available from: https://aip.scitation.org/doi/10.1063/1.4982940
Vancouver
Jones DB, Limao-Vieira P, Mendes M, Jones NC, Hoffmann SV, Costa RF da, Bettega MHF, Blanco F, Garcia G, Ingolfsson O, Lima MAP, Brunger MJ, Varella MT do N. An experimental and theoretical investigation into the electronically excited states of para-benzoquinone [Internet]. Journal of Chemical Physics. 2017 ; 146( 18): 184303.[citado 2024 nov. 15 ] Available from: https://aip.scitation.org/doi/10.1063/1.4982940
Artigo de periodico
How does methylation suppress the electron-induced decomposition of 1-methyl-nitroimidazoles? (2017)
Kossoski, F.; Varella, Márcio Teixeira do Nascimento
Source: Journal of Chemical Physics. Unidade: IF
Subjects: ESPECTROMETRIA, ÍONS
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KOSSOSKI, F. e VARELLA, Márcio Teixeira do Nascimento. How does methylation suppress the electron-induced decomposition of 1-methyl-nitroimidazoles?. Journal of Chemical Physics, v. 147, n. 16, p. 164310, 2017Tradução . . Disponível em: https://aip.scitation.org/doi/10.1063/1.5005604. Acesso em: 15 nov. 2024.
APA
Kossoski, F., & Varella, M. T. do N. (2017). How does methylation suppress the electron-induced decomposition of 1-methyl-nitroimidazoles? Journal of Chemical Physics, 147( 16), 164310. doi:10.1063/1.5005604
NLM
Kossoski F, Varella MT do N. How does methylation suppress the electron-induced decomposition of 1-methyl-nitroimidazoles? [Internet]. Journal of Chemical Physics. 2017 ; 147( 16): 164310.[citado 2024 nov. 15 ] Available from: https://aip.scitation.org/doi/10.1063/1.5005604
Vancouver
Kossoski F, Varella MT do N. How does methylation suppress the electron-induced decomposition of 1-methyl-nitroimidazoles? [Internet]. Journal of Chemical Physics. 2017 ; 147( 16): 164310.[citado 2024 nov. 15 ] Available from: https://aip.scitation.org/doi/10.1063/1.5005604
Artigo de periodico
Transient anion spectra of the potential radiosensitizers 5-cyanateuracil and 5-thiocyanateuracil (2017)
Cornetta, L. M.; Kossoski, F.; Varella, Márcio Teixeira do Nascimento
Source: Journal of Chemical Physics. Unidade: IF
Subjects: ESPECTROMETRIA, ÍONS
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CORNETTA, L. M. e KOSSOSKI, F. e VARELLA, Márcio Teixeira do Nascimento. Transient anion spectra of the potential radiosensitizers 5-cyanateuracil and 5-thiocyanateuracil. Journal of Chemical Physics, v. 147, n. 21, p. 214310, 2017Tradução . . Disponível em: https://aip.scitation.org/doi/10.1063/1.5007050. Acesso em: 15 nov. 2024.
APA
Cornetta, L. M., Kossoski, F., & Varella, M. T. do N. (2017). Transient anion spectra of the potential radiosensitizers 5-cyanateuracil and 5-thiocyanateuracil. Journal of Chemical Physics, 147( 21), 214310. doi:10.1063/1.5007050
NLM
Cornetta LM, Kossoski F, Varella MT do N. Transient anion spectra of the potential radiosensitizers 5-cyanateuracil and 5-thiocyanateuracil [Internet]. Journal of Chemical Physics. 2017 ; 147( 21): 214310.[citado 2024 nov. 15 ] Available from: https://aip.scitation.org/doi/10.1063/1.5007050
Vancouver
Cornetta LM, Kossoski F, Varella MT do N. Transient anion spectra of the potential radiosensitizers 5-cyanateuracil and 5-thiocyanateuracil [Internet]. Journal of Chemical Physics. 2017 ; 147( 21): 214310.[citado 2024 nov. 15 ] Available from: https://aip.scitation.org/doi/10.1063/1.5007050
Artigo de periodico
Experimental and theoretical investigation of the first-order hyperpolarizability of a class of triarylamine derivatives (2015)
Silva, Daniel L.; Fonseca, Ruben D.; Vivas, Marcelo G.; Ishow, E.; Canuto, Sylvio; Mendonça, Cleber Renato ; De Boni, Leonardo
Source: Journal of Chemical Physics. Unidades: IF, IFSC
Subjects: FOTÔNICA, NANOPARTÍCULAS
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SILVA, Daniel L. et al. Experimental and theoretical investigation of the first-order hyperpolarizability of a class of triarylamine derivatives. Journal of Chemical Physics, v. 142, n. 6, p. 064312-1-064312-12, 2015Tradução . . Disponível em: https://doi.org/10.1063/1.4906893. Acesso em: 15 nov. 2024.
APA
Silva, D. L., Fonseca, R. D., Vivas, M. G., Ishow, E., Canuto, S., Mendonça, C. R., & De Boni, L. (2015). Experimental and theoretical investigation of the first-order hyperpolarizability of a class of triarylamine derivatives. Journal of Chemical Physics, 142( 6), 064312-1-064312-12. doi:10.1063/1.4906893
NLM
Silva DL, Fonseca RD, Vivas MG, Ishow E, Canuto S, Mendonça CR, De Boni L. Experimental and theoretical investigation of the first-order hyperpolarizability of a class of triarylamine derivatives [Internet]. Journal of Chemical Physics. 2015 ; 142( 6): 064312-1-064312-12.[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/1.4906893
Vancouver
Silva DL, Fonseca RD, Vivas MG, Ishow E, Canuto S, Mendonça CR, De Boni L. Experimental and theoretical investigation of the first-order hyperpolarizability of a class of triarylamine derivatives [Internet]. Journal of Chemical Physics. 2015 ; 142( 6): 064312-1-064312-12.[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/1.4906893
Artigo de periodico
Theoretical study of the absorption and nonradiative deactivation of 1-nitronaphthalene in the low-lying singlet and triplet excited states including methanol and ethanol solvent effects (2012)
Orozco-Gonzalez, Yoelvis; Peon, Jorge; Coutinho, Kaline ; Canuto, Sylvio
Source: Journal of Chemical Physics. Unidade: IF
Subjects: FOSFORESCÊNCIA, ESPECTROSCOPIA ULTRAVIOLETA, FÍSICO-QUÍMICA
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OROZCO-GONZALEZ, Yoelvis et al. Theoretical study of the absorption and nonradiative deactivation of 1-nitronaphthalene in the low-lying singlet and triplet excited states including methanol and ethanol solvent effects. Journal of Chemical Physics, v. 137, n. 5, p. 054307, 2012Tradução . . Disponível em: https://doi.org/10.1063/1.4738757. Acesso em: 15 nov. 2024.
APA
Orozco-Gonzalez, Y., Peon, J., Coutinho, K., & Canuto, S. (2012). Theoretical study of the absorption and nonradiative deactivation of 1-nitronaphthalene in the low-lying singlet and triplet excited states including methanol and ethanol solvent effects. Journal of Chemical Physics, 137( 5), 054307. doi:10.1063/1.4738757
NLM
Orozco-Gonzalez Y, Peon J, Coutinho K, Canuto S. Theoretical study of the absorption and nonradiative deactivation of 1-nitronaphthalene in the low-lying singlet and triplet excited states including methanol and ethanol solvent effects [Internet]. Journal of Chemical Physics. 2012 ;137( 5): 054307.[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/1.4738757
Vancouver
Orozco-Gonzalez Y, Peon J, Coutinho K, Canuto S. Theoretical study of the absorption and nonradiative deactivation of 1-nitronaphthalene in the low-lying singlet and triplet excited states including methanol and ethanol solvent effects [Internet]. Journal of Chemical Physics. 2012 ;137( 5): 054307.[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/1.4738757
Artigo de periodico
Structure and anomalous solubility for hard spheres in an associating lattice gas model (2012)
Szortyka, Marcia M; Girardi, Mauricio; Barbosa, Marcia C; Henriques, Vera Bohomoletz
Source: Journal of Chemical Physics. Unidade: IF
Subjects: MÉTODO DE MONTE CARLO (SIMULAÇÃO), ESTADO LÍQUIDO (PROPRIEDADES), SOLUBILIDADE
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SZORTYKA, Marcia M et al. Structure and anomalous solubility for hard spheres in an associating lattice gas model. Journal of Chemical Physics, v. 137, n. 6, p. 064905/1/064905/8, 2012Tradução . . Disponível em: https://doi.org/10.1063/1.4743635. Acesso em: 15 nov. 2024.
APA
Szortyka, M. M., Girardi, M., Barbosa, M. C., & Henriques, V. B. (2012). Structure and anomalous solubility for hard spheres in an associating lattice gas model. Journal of Chemical Physics, 137( 6), 064905/1/064905/8. doi:10.1063/1.4743635
NLM
Szortyka MM, Girardi M, Barbosa MC, Henriques VB. Structure and anomalous solubility for hard spheres in an associating lattice gas model [Internet]. Journal of Chemical Physics. 2012 ;137( 6): 064905/1/064905/8.[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/1.4743635
Vancouver
Szortyka MM, Girardi M, Barbosa MC, Henriques VB. Structure and anomalous solubility for hard spheres in an associating lattice gas model [Internet]. Journal of Chemical Physics. 2012 ;137( 6): 064905/1/064905/8.[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/1.4743635
Artigo de periodico
Positron scattering from the cyclic ethers oxirane, 1,4-dioxane, and tetrahydropyran (2012)
Zecca, A; Trainotti, E.; Chiari, L.; Bettega, M. H. F.; d'A Sanchez, S.; Varella, Márcio Teixeira do Nascimento ; Lima, M. A. P.; Brunger, M. J.
Source: Journal of Chemical Physics. Unidade: IF
Assunto: CAMPO MAGNÉTICO
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ABNT
ZECCA, A et al. Positron scattering from the cyclic ethers oxirane, 1,4-dioxane, and tetrahydropyran. Journal of Chemical Physics, 2012Tradução . . Disponível em: https://doi.org/10.1063/1.3696378. Acesso em: 15 nov. 2024.
APA
Zecca, A., Trainotti, E., Chiari, L., Bettega, M. H. F., d'A Sanchez, S., Varella, M. T. do N., et al. (2012). Positron scattering from the cyclic ethers oxirane, 1,4-dioxane, and tetrahydropyran. Journal of Chemical Physics. doi:10.1063/1.3696378
NLM
Zecca A, Trainotti E, Chiari L, Bettega MHF, d'A Sanchez S, Varella MT do N, Lima MAP, Brunger MJ. Positron scattering from the cyclic ethers oxirane, 1,4-dioxane, and tetrahydropyran [Internet]. Journal of Chemical Physics. 2012 ;[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/1.3696378
Vancouver
Zecca A, Trainotti E, Chiari L, Bettega MHF, d'A Sanchez S, Varella MT do N, Lima MAP, Brunger MJ. Positron scattering from the cyclic ethers oxirane, 1,4-dioxane, and tetrahydropyran [Internet]. Journal of Chemical Physics. 2012 ;[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/1.3696378
Artigo de periodico
Structural properties and energetics of diffuse 'ANTPOT. 87'RB' clusters in three-dimension (2012)
Debnath, Pankaj Kumar; Das, Tapan Kumar; Canuto, Sylvio
Source: Journal of Chemical Physics. Unidade: IF
Assunto: CLUSTERS
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
DEBNATH, Pankaj Kumar e DAS, Tapan Kumar e CANUTO, Sylvio. Structural properties and energetics of diffuse 'ANTPOT. 87'RB' clusters in three-dimension. Journal of Chemical Physics, v. 137, n. 1, p. 014301, 2012Tradução . . Disponível em: https://doi.org/10.1063/1.4730972. Acesso em: 15 nov. 2024.
APA
Debnath, P. K., Das, T. K., & Canuto, S. (2012). Structural properties and energetics of diffuse 'ANTPOT. 87'RB' clusters in three-dimension. Journal of Chemical Physics, 137( 1), 014301. doi:10.1063/1.4730972
NLM
Debnath PK, Das TK, Canuto S. Structural properties and energetics of diffuse 'ANTPOT. 87'RB' clusters in three-dimension [Internet]. Journal of Chemical Physics. 2012 ;137( 1): 014301.[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/1.4730972
Vancouver
Debnath PK, Das TK, Canuto S. Structural properties and energetics of diffuse 'ANTPOT. 87'RB' clusters in three-dimension [Internet]. Journal of Chemical Physics. 2012 ;137( 1): 014301.[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/1.4730972
Artigo de periodico
Experimental and theoretical study of two-photon absorption in nitrofuran derivatives: promising compounds for photochemotherapy (2011)
De Boni, Leonardo ; Correa, D. S. ; Silva, D. L. ; Gonçalves, P. J.; Zílio, Sérgio Carlos ; Parra, Gustavo G. ; Borissevitch, Iouri ; Canuto, Sylvio ; Mendonça, Cleber Renato
Source: Journal of Chemical Physics. Unidades: IFSC, FFCLRP, IF
Subjects: FOTÔNICA, ABSORÇÃO DA LUZ, DENSIDADE (TEORIA), FÁRMACOS (ESTUDO), ANTINEOPLÁSICOS (ESTUDO)
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
DE BONI, Leonardo et al. Experimental and theoretical study of two-photon absorption in nitrofuran derivatives: promising compounds for photochemotherapy. Journal of Chemical Physics, v. 134, n. Ja 2011, p. 144509-1-144509-5, 2011Tradução . . Disponível em: https://doi.org/10.1063/1.3514911. Acesso em: 15 nov. 2024.
APA
De Boni, L., Correa, D. S., Silva, D. L., Gonçalves, P. J., Zílio, S. C., Parra, G. G., et al. (2011). Experimental and theoretical study of two-photon absorption in nitrofuran derivatives: promising compounds for photochemotherapy. Journal of Chemical Physics, 134( Ja 2011), 144509-1-144509-5. doi:10.1063/1.3514911
NLM
De Boni L, Correa DS, Silva DL, Gonçalves PJ, Zílio SC, Parra GG, Borissevitch I, Canuto S, Mendonça CR. Experimental and theoretical study of two-photon absorption in nitrofuran derivatives: promising compounds for photochemotherapy [Internet]. Journal of Chemical Physics. 2011 ; 134( Ja 2011): 144509-1-144509-5.[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/1.3514911
Vancouver
De Boni L, Correa DS, Silva DL, Gonçalves PJ, Zílio SC, Parra GG, Borissevitch I, Canuto S, Mendonça CR. Experimental and theoretical study of two-photon absorption in nitrofuran derivatives: promising compounds for photochemotherapy [Internet]. Journal of Chemical Physics. 2011 ; 134( Ja 2011): 144509-1-144509-5.[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/1.3514911
Artigo de periodico
Hyperpolarizabilities of the methanol molecule: a CCSD calculation including vibrational corrections (2010)
Dutra, Adriano S; Castro, Marcos A; Fonseca, Tertius L; Fileti, Eudes Eterno; Canuto, Sylvio
Source: Journal of Chemical Physics. Unidade: IF
Subjects: METANOL, PARTÍCULAS (FÍSICA NUCLEAR)
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
DUTRA, Adriano S et al. Hyperpolarizabilities of the methanol molecule: a CCSD calculation including vibrational corrections. Journal of Chemical Physics, v. 132, n. 034307/1-034307/8, 2010Tradução . . Disponível em: https://doi.org/10.1063/1.3298914. Acesso em: 15 nov. 2024.
APA
Dutra, A. S., Castro, M. A., Fonseca, T. L., Fileti, E. E., & Canuto, S. (2010). Hyperpolarizabilities of the methanol molecule: a CCSD calculation including vibrational corrections. Journal of Chemical Physics, 132( 034307/1-034307/8). doi:10.1063/1.3298914
NLM
Dutra AS, Castro MA, Fonseca TL, Fileti EE, Canuto S. Hyperpolarizabilities of the methanol molecule: a CCSD calculation including vibrational corrections [Internet]. Journal of Chemical Physics. 2010 ; 132( 034307/1-034307/8):[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/1.3298914
Vancouver
Dutra AS, Castro MA, Fonseca TL, Fileti EE, Canuto S. Hyperpolarizabilities of the methanol molecule: a CCSD calculation including vibrational corrections [Internet]. Journal of Chemical Physics. 2010 ; 132( 034307/1-034307/8):[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/1.3298914
Artigo de periodico
Diffusion anomaly and dynamic transitions in the Bell–Lavis water model (2010)
Szortyka, Márcia M; Fiore, Carlos Eduardo; Henriques, Vera Bohomoletz; Barbosa, Marcia C
Source: Journal of Chemical Physics. Unidade: IF
Subjects: TERMODINÂMICA, MÉTODO DE MONTE CARLO
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
SZORTYKA, Márcia M et al. Diffusion anomaly and dynamic transitions in the Bell–Lavis water model. Journal of Chemical Physics, v. 133, n. 10, p. 1049043/1-104904/6, 2010Tradução . . Disponível em: https://doi.org/10.1063/1.3479001. Acesso em: 15 nov. 2024.
APA
Szortyka, M. M., Fiore, C. E., Henriques, V. B., & Barbosa, M. C. (2010). Diffusion anomaly and dynamic transitions in the Bell–Lavis water model. Journal of Chemical Physics, 133( 10), 1049043/1-104904/6. doi:10.1063/1.3479001
NLM
Szortyka MM, Fiore CE, Henriques VB, Barbosa MC. Diffusion anomaly and dynamic transitions in the Bell–Lavis water model [Internet]. Journal of Chemical Physics. 2010 ; 133( 10): 1049043/1-104904/6.[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/1.3479001
Vancouver
Szortyka MM, Fiore CE, Henriques VB, Barbosa MC. Diffusion anomaly and dynamic transitions in the Bell–Lavis water model [Internet]. Journal of Chemical Physics. 2010 ; 133( 10): 1049043/1-104904/6.[citado 2024 nov. 15 ] Available from: https://doi.org/10.1063/1.3479001

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