ReP USP - Resultado da busca

Trabalho de evento-resumo
Accurate relativistic electronic structure calculations of homonuclear diatomic molecules: Hg2, Cn2, and Fl2 (2025)
Haiduke, Roberto Luiz Andrade
Source: Abstracts. Conference titles: International Congress of Theoretical Chemists of Latin Expression Cartagena - Quitel. Unidade: IQSC
Subjects: MOLÉCULA, ESTRUTURA ELETRÔNICA, QUÍMICA
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
HAIDUKE, Roberto Luiz Andrade. Accurate relativistic electronic structure calculations of homonuclear diatomic molecules: Hg2, Cn2, and Fl2. 2025, Anais.. Cartagena: Instituto de Química de São Carlos, Universidade de São Paulo, 2025. Disponível em: https://repositorio.usp.br/directbitstream/42ad9aa9-1a2b-4774-93d5-1373624f7f32/P22192.pdf. Acesso em: 04 nov. 2025.
APA
Haiduke, R. L. A. (2025). Accurate relativistic electronic structure calculations of homonuclear diatomic molecules: Hg2, Cn2, and Fl2. In Abstracts. Cartagena: Instituto de Química de São Carlos, Universidade de São Paulo. Recuperado de https://repositorio.usp.br/directbitstream/42ad9aa9-1a2b-4774-93d5-1373624f7f32/P22192.pdf
NLM
Haiduke RLA. Accurate relativistic electronic structure calculations of homonuclear diatomic molecules: Hg2, Cn2, and Fl2 [Internet]. Abstracts. 2025 ;[citado 2025 nov. 04 ] Available from: https://repositorio.usp.br/directbitstream/42ad9aa9-1a2b-4774-93d5-1373624f7f32/P22192.pdf
Vancouver
Haiduke RLA. Accurate relativistic electronic structure calculations of homonuclear diatomic molecules: Hg2, Cn2, and Fl2 [Internet]. Abstracts. 2025 ;[citado 2025 nov. 04 ] Available from: https://repositorio.usp.br/directbitstream/42ad9aa9-1a2b-4774-93d5-1373624f7f32/P22192.pdf
Artigo de periodico
An electronic structure investigation of excited state intramolecular proton transfer in amino-benzazole derivatives: Relative energies and electron density descriptors (2023)
Mendes, Rodrigo Araujo ; Mata, V.A.S. da; Haiduke, Roberto Luiz Andrade
Source: Journal of Photochemistry and Photobiology, A: Chemistry. Unidade: IQSC
Subjects: ESTRUTURA ELETRÔNICA, QUÍMICA TEÓRICA
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
MENDES, Rodrigo Araujo e MATA, V.A.S. da e HAIDUKE, Roberto Luiz Andrade. An electronic structure investigation of excited state intramolecular proton transfer in amino-benzazole derivatives: Relative energies and electron density descriptors. Journal of Photochemistry and Photobiology, A: Chemistry, v. 441, p. 114738, 2023Tradução . . Disponível em: https://doi.org/10.1016/j.jphotochem.2023.114738. Acesso em: 04 nov. 2025.
APA
Mendes, R. A., Mata, V. A. S. da, & Haiduke, R. L. A. (2023). An electronic structure investigation of excited state intramolecular proton transfer in amino-benzazole derivatives: Relative energies and electron density descriptors. Journal of Photochemistry and Photobiology, A: Chemistry, 441, 114738. doi:10.1016/j.jphotochem.2023.114738
NLM
Mendes RA, Mata VAS da, Haiduke RLA. An electronic structure investigation of excited state intramolecular proton transfer in amino-benzazole derivatives: Relative energies and electron density descriptors [Internet]. Journal of Photochemistry and Photobiology, A: Chemistry. 2023 ;441 114738.[citado 2025 nov. 04 ] Available from: https://doi.org/10.1016/j.jphotochem.2023.114738
Vancouver
Mendes RA, Mata VAS da, Haiduke RLA. An electronic structure investigation of excited state intramolecular proton transfer in amino-benzazole derivatives: Relative energies and electron density descriptors [Internet]. Journal of Photochemistry and Photobiology, A: Chemistry. 2023 ;441 114738.[citado 2025 nov. 04 ] Available from: https://doi.org/10.1016/j.jphotochem.2023.114738
Artigo de periodico
Accurate rate constants for elementary reactions of molecular hydrogen and carbon monoxide mixtures and the role of the H2 rich environment (2022)
Vichietti, Rafael M.; Spada, Rene F. K.; Machado, Francisco B. C.; Haiduke, Roberto Luiz Andrade
Source: Journal of Molecular Modeling. Unidade: IQSC
Subjects: ESTRUTURA ELETRÔNICA, QUÍMICA TEÓRICA, HIDROGÊNIO
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
VICHIETTI, Rafael M. et al. Accurate rate constants for elementary reactions of molecular hydrogen and carbon monoxide mixtures and the role of the H2 rich environment. Journal of Molecular Modeling, v. 28, p. 229, 2022Tradução . . Disponível em: https://doi.org/10.1007/s00894-022-05207-7. Acesso em: 04 nov. 2025.
APA
Vichietti, R. M., Spada, R. F. K., Machado, F. B. C., & Haiduke, R. L. A. (2022). Accurate rate constants for elementary reactions of molecular hydrogen and carbon monoxide mixtures and the role of the H2 rich environment. Journal of Molecular Modeling, 28, 229. doi:10.1007/s00894-022-05207-7
NLM
Vichietti RM, Spada RFK, Machado FBC, Haiduke RLA. Accurate rate constants for elementary reactions of molecular hydrogen and carbon monoxide mixtures and the role of the H2 rich environment [Internet]. Journal of Molecular Modeling. 2022 ;28 229.[citado 2025 nov. 04 ] Available from: https://doi.org/10.1007/s00894-022-05207-7
Vancouver
Vichietti RM, Spada RFK, Machado FBC, Haiduke RLA. Accurate rate constants for elementary reactions of molecular hydrogen and carbon monoxide mixtures and the role of the H2 rich environment [Internet]. Journal of Molecular Modeling. 2022 ;28 229.[citado 2025 nov. 04 ] Available from: https://doi.org/10.1007/s00894-022-05207-7
Artigo de periodico
An Electronic Structure Study of the Conversion from 1,2-diphenylacetylene to (E)-1,2-diphenylethene Using a Bidentate Ru(II) - NC Catalyst (2022)
Curichimba, Jeyson Esquivel; Haiduke, Roberto Luiz Andrade
Source: European Journal of Inorganic Chemistry. Unidade: IQSC
Subjects: ESTRUTURA ELETRÔNICA, CATALISADORES, MECANISMOS
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
CURICHIMBA, Jeyson Esquivel e HAIDUKE, Roberto Luiz Andrade. An Electronic Structure Study of the Conversion from 1,2-diphenylacetylene to (E)-1,2-diphenylethene Using a Bidentate Ru(II) - NC Catalyst. European Journal of Inorganic Chemistry, p. e202200525, 2022Tradução . . Disponível em: https://doi.org/10.1002/ejic.202200525. Acesso em: 04 nov. 2025.
APA
Curichimba, J. E., & Haiduke, R. L. A. (2022). An Electronic Structure Study of the Conversion from 1,2-diphenylacetylene to (E)-1,2-diphenylethene Using a Bidentate Ru(II) - NC Catalyst. European Journal of Inorganic Chemistry, e202200525. doi:10.1002/ejic.202200525
NLM
Curichimba JE, Haiduke RLA. An Electronic Structure Study of the Conversion from 1,2-diphenylacetylene to (E)-1,2-diphenylethene Using a Bidentate Ru(II) - NC Catalyst [Internet]. European Journal of Inorganic Chemistry. 2022 ;e202200525.[citado 2025 nov. 04 ] Available from: https://doi.org/10.1002/ejic.202200525
Vancouver
Curichimba JE, Haiduke RLA. An Electronic Structure Study of the Conversion from 1,2-diphenylacetylene to (E)-1,2-diphenylethene Using a Bidentate Ru(II) - NC Catalyst [Internet]. European Journal of Inorganic Chemistry. 2022 ;e202200525.[citado 2025 nov. 04 ] Available from: https://doi.org/10.1002/ejic.202200525
Artigo de periodico
A charge-charge flux-dipole flux decomposition of the dipole moment derivatives and infrared intensities of the AB(3) (A = N, P; B = H, F) molecules (2005)
César, Paulo H.; Faria, Sérgio H. D. M.; Silva Jr., João V. da; Haiduke, Roberto Luiz Andrade ; Bruns, Roy Edward
Source: Chemical Physics. Unidade: IQ
Subjects: QUÍMICA ORGÂNICA, ESTRUTURA ELETRÔNICA
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
CÉSAR, Paulo H. et al. A charge-charge flux-dipole flux decomposition of the dipole moment derivatives and infrared intensities of the AB(3) (A = N, P; B = H, F) molecules. Chemical Physics, v. 317, n. 1, p. 35-42, 2005Tradução . . Disponível em: https://doi.org/10.1016/j.chemphys.2005.05.029. Acesso em: 04 nov. 2025.
APA
César, P. H., Faria, S. H. D. M., Silva Jr., J. V. da, Haiduke, R. L. A., & Bruns, R. E. (2005). A charge-charge flux-dipole flux decomposition of the dipole moment derivatives and infrared intensities of the AB(3) (A = N, P; B = H, F) molecules. Chemical Physics, 317( 1), 35-42. doi:10.1016/j.chemphys.2005.05.029
NLM
César PH, Faria SHDM, Silva Jr. JV da, Haiduke RLA, Bruns RE. A charge-charge flux-dipole flux decomposition of the dipole moment derivatives and infrared intensities of the AB(3) (A = N, P; B = H, F) molecules [Internet]. Chemical Physics. 2005 ; 317( 1): 35-42.[citado 2025 nov. 04 ] Available from: https://doi.org/10.1016/j.chemphys.2005.05.029
Vancouver
César PH, Faria SHDM, Silva Jr. JV da, Haiduke RLA, Bruns RE. A charge-charge flux-dipole flux decomposition of the dipole moment derivatives and infrared intensities of the AB(3) (A = N, P; B = H, F) molecules [Internet]. Chemical Physics. 2005 ; 317( 1): 35-42.[citado 2025 nov. 04 ] Available from: https://doi.org/10.1016/j.chemphys.2005.05.029
Trabalho de evento-resumo
Determination of atomic anisotropies from gasphase infrared intensities (2003)
Haiduke, Roberto Luiz Andrade ; Oliveira, Anselmo E. de; Bruns, Roy Edward
Source: Livro de Resumos. Conference titles: Simpósio Brasileiro de Química Teórica. Unidade: IQ
Subjects: ESTRUTURA ELETRÔNICA, QUÍMICA TEÓRICA, QUÍMICA ORGÂNICA
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
HAIDUKE, Roberto Luiz Andrade e OLIVEIRA, Anselmo E. de e BRUNS, Roy Edward. Determination of atomic anisotropies from gasphase infrared intensities. 2003, Anais.. Caxambu: Instituto de Química, Universidade de São Paulo, 2003. . Acesso em: 04 nov. 2025.
APA
Haiduke, R. L. A., Oliveira, A. E. de, & Bruns, R. E. (2003). Determination of atomic anisotropies from gasphase infrared intensities. In Livro de Resumos. Caxambu: Instituto de Química, Universidade de São Paulo.
NLM
Haiduke RLA, Oliveira AE de, Bruns RE. Determination of atomic anisotropies from gasphase infrared intensities. Livro de Resumos. 2003 ;[citado 2025 nov. 04 ]
Vancouver
Haiduke RLA, Oliveira AE de, Bruns RE. Determination of atomic anisotropies from gasphase infrared intensities. Livro de Resumos. 2003 ;[citado 2025 nov. 04 ]

USP Schools

ReP

Filtros

Authors

Subjects

Source title

Indexado em