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Artigo de periodico
Ruthenium(II)-arene complexes containing β-diketonates: Leishmanicidal activity evaluated by the combination of experimental data, docking and DFT calculations (2026)
Macêdo, Roberta R.; Miranda, Victor M; Costa, Tássia S. R. da; Teixeira, Renata M.S.; Silva, Samuel de Souza e; Machado, Antônio E. H.; Oliveira, Guedmiller Souza de; Araujo, Diesley Martins da Silva; Deflon, Victor Marcelo; Maia, Pedro Ivo da Silva; Yoneyama, Kelly A.G.; Von Poelhsitz, Gustavo
Source: Journal of Molecular Structure. Unidade: IQSC
Subjects: RUTÊNIO, ANTIPARASITÁRIOS, ESTRUTURA ELETRÔNICA
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ABNT
MACÊDO, Roberta R. et al. Ruthenium(II)-arene complexes containing β-diketonates: Leishmanicidal activity evaluated by the combination of experimental data, docking and DFT calculations. Journal of Molecular Structure, 2026Tradução . . Disponível em: https://doi.org/10.1016/j.molstruc.2025.144215. Acesso em: 07 nov. 2025.
APA
Macêdo, R. R., Miranda, V. M., Costa, T. S. R. da, Teixeira, R. M. S., Silva, S. de S. e, Machado, A. E. H., et al. (2026). Ruthenium(II)-arene complexes containing β-diketonates: Leishmanicidal activity evaluated by the combination of experimental data, docking and DFT calculations. Journal of Molecular Structure. doi:10.1016/j.molstruc.2025.144215
NLM
Macêdo RR, Miranda VM, Costa TSR da, Teixeira RMS, Silva S de S e, Machado AEH, Oliveira GS de, Araujo DM da S, Deflon VM, Maia PI da S, Yoneyama KAG, Von Poelhsitz G. Ruthenium(II)-arene complexes containing β-diketonates: Leishmanicidal activity evaluated by the combination of experimental data, docking and DFT calculations [Internet]. Journal of Molecular Structure. 2026 ;[citado 2025 nov. 07 ] Available from: https://doi.org/10.1016/j.molstruc.2025.144215
Vancouver
Macêdo RR, Miranda VM, Costa TSR da, Teixeira RMS, Silva S de S e, Machado AEH, Oliveira GS de, Araujo DM da S, Deflon VM, Maia PI da S, Yoneyama KAG, Von Poelhsitz G. Ruthenium(II)-arene complexes containing β-diketonates: Leishmanicidal activity evaluated by the combination of experimental data, docking and DFT calculations [Internet]. Journal of Molecular Structure. 2026 ;[citado 2025 nov. 07 ] Available from: https://doi.org/10.1016/j.molstruc.2025.144215
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
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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: 07 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. 07 ] 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. 07 ] Available from: https://repositorio.usp.br/directbitstream/42ad9aa9-1a2b-4774-93d5-1373624f7f32/P22192.pdf
Artigo de periodico
Interplay between optical and electronic characteristics of castor oil-derived hybrid polymers (2025)
Garcia, Francis Dayan Rivas ; Nieto, Edgar F. Pinzón; Onishi, Bruno Seiki Domingos ; Santos, Ricardo Bortoletto ; Freitas, Beatriz Damasio de ; Santos, Adriano dos; Manzani, Danilo ; Bueno, Paulo Roberto; Ribeiro, Sidney José Lima
Source: ACS Applied Electronic Materials. Unidade: IQSC
Subjects: POLÍMEROS (QUÍMICA ORGÂNICA), ESTRUTURA ELETRÔNICA
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ABNT
GARCIA, Francis Dayan Rivas et al. Interplay between optical and electronic characteristics of castor oil-derived hybrid polymers. ACS Applied Electronic Materials, v. 7, n. 17, p. 8034–8044, 2025Tradução . . Disponível em: https://doi.org/10.1021/acsaelm.5c00826. Acesso em: 07 nov. 2025.
APA
Garcia, F. D. R., Nieto, E. F. P., Onishi, B. S. D., Santos, R. B., Freitas, B. D. de, Santos, A. dos, et al. (2025). Interplay between optical and electronic characteristics of castor oil-derived hybrid polymers. ACS Applied Electronic Materials, 7( 17), 8034–8044. doi:10.1021/acsaelm.5c00826
NLM
Garcia FDR, Nieto EFP, Onishi BSD, Santos RB, Freitas BD de, Santos A dos, Manzani D, Bueno PR, Ribeiro SJL. Interplay between optical and electronic characteristics of castor oil-derived hybrid polymers [Internet]. ACS Applied Electronic Materials. 2025 ; 7( 17): 8034–8044.[citado 2025 nov. 07 ] Available from: https://doi.org/10.1021/acsaelm.5c00826
Vancouver
Garcia FDR, Nieto EFP, Onishi BSD, Santos RB, Freitas BD de, Santos A dos, Manzani D, Bueno PR, Ribeiro SJL. Interplay between optical and electronic characteristics of castor oil-derived hybrid polymers [Internet]. ACS Applied Electronic Materials. 2025 ; 7( 17): 8034–8044.[citado 2025 nov. 07 ] Available from: https://doi.org/10.1021/acsaelm.5c00826
Trabalho de evento
Optimizing molecular descriptors for reliable adsorption energy prediction on transition metal nanoclusters (2024)
Pena, Lucas B; Calderan, Felipe V ; Quiles, Marcos Gonçalves ; Galvão, Breno R. L. ; Silva, Juarez Lopes Ferreira da
Source: Livro de Resumos. Conference titles: Simpósio de Estrutura Eletrônica e Dinâmica Molecular - SEEDMOL. Unidade: IQSC
Subjects: ESTRUTURA ELETRÔNICA, ADSORÇÃO, METAIS
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ABNT
PENA, Lucas B et al. Optimizing molecular descriptors for reliable adsorption energy prediction on transition metal nanoclusters. 2024, Anais.. Pirenópolis: Instituto de Química de São Carlos, Universidade de São Paulo, 2024. Disponível em: https://www.seedmol.com.br/. Acesso em: 07 nov. 2025.
APA
Pena, L. B., Calderan, F. V., Quiles, M. G., Galvão, B. R. L., & Silva, J. L. F. da. (2024). Optimizing molecular descriptors for reliable adsorption energy prediction on transition metal nanoclusters. In Livro de Resumos. Pirenópolis: Instituto de Química de São Carlos, Universidade de São Paulo. Recuperado de https://www.seedmol.com.br/
NLM
Pena LB, Calderan FV, Quiles MG, Galvão BRL, Silva JLF da. Optimizing molecular descriptors for reliable adsorption energy prediction on transition metal nanoclusters [Internet]. Livro de Resumos. 2024 ;[citado 2025 nov. 07 ] Available from: https://www.seedmol.com.br/
Vancouver
Pena LB, Calderan FV, Quiles MG, Galvão BRL, Silva JLF da. Optimizing molecular descriptors for reliable adsorption energy prediction on transition metal nanoclusters [Internet]. Livro de Resumos. 2024 ;[citado 2025 nov. 07 ] Available from: https://www.seedmol.com.br/
Artigo de periodico
Relativistic adapted Gaussian basis sets free of variational prolapse of small and medium size for cesium through radon (2023)
Gusmão, Eriosvaldo Florentino ; Haiduke, Roberto Luiz Andrade
Source: Journal of Computational Chemistry. Unidade: IQSC
Subjects: ESTRUTURA ELETRÔNICA, CÉSIO
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ABNT
GUSMÃO, Eriosvaldo Florentino e HAIDUKE, Roberto Luiz Andrade. Relativistic adapted Gaussian basis sets free of variational prolapse of small and medium size for cesium through radon. Journal of Computational Chemistry, v. 44, p. 2478–2485, 2023Tradução . . Disponível em: https://doi.org/10.1002/jcc.27212. Acesso em: 07 nov. 2025.
APA
Gusmão, E. F., & Haiduke, R. L. A. (2023). Relativistic adapted Gaussian basis sets free of variational prolapse of small and medium size for cesium through radon. Journal of Computational Chemistry, 44, 2478–2485. doi:10.1002/jcc.27212
NLM
Gusmão EF, Haiduke RLA. Relativistic adapted Gaussian basis sets free of variational prolapse of small and medium size for cesium through radon [Internet]. Journal of Computational Chemistry. 2023 ;44 2478–2485.[citado 2025 nov. 07 ] Available from: https://doi.org/10.1002/jcc.27212
Vancouver
Gusmão EF, Haiduke RLA. Relativistic adapted Gaussian basis sets free of variational prolapse of small and medium size for cesium through radon [Internet]. Journal of Computational Chemistry. 2023 ;44 2478–2485.[citado 2025 nov. 07 ] Available from: https://doi.org/10.1002/jcc.27212
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
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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: 07 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. 07 ] 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. 07 ] 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
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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: 07 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. 07 ] 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. 07 ] 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
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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: 07 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. 07 ] 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. 07 ] Available from: https://doi.org/10.1002/ejic.202200525
Trabalho de evento
A new strategy to model the mechanism of action of covalent inhibitors (2022)
Bonatto, Vinícius ; Lameira, Jerônimo ; Luque, F. Javier; Montanari, Carlos Alberto
Source: Livro de Resumos. Conference titles: Simpósio de Estrutura Eletrônica e Dinâmica Molecular - SEEDMOL. Unidade: IQSC
Subjects: ESTRUTURA ELETRÔNICA, NITRILAS
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ABNT
BONATTO, Vinícius et al. A new strategy to model the mechanism of action of covalent inhibitors. 2022, Anais.. Brasília: Instituto de Química de São Carlos, Universidade de São Paulo, 2022. Disponível em: https://repositorio.usp.br/directbitstream/91f0655c-30cf-45d4-ab03-731ea11970ad/P22199.pdf. Acesso em: 07 nov. 2025.
APA
Bonatto, V., Lameira, J., Luque, F. J., & Montanari, C. A. (2022). A new strategy to model the mechanism of action of covalent inhibitors. In Livro de Resumos. Brasília: Instituto de Química de São Carlos, Universidade de São Paulo. Recuperado de https://repositorio.usp.br/directbitstream/91f0655c-30cf-45d4-ab03-731ea11970ad/P22199.pdf
NLM
Bonatto V, Lameira J, Luque FJ, Montanari CA. A new strategy to model the mechanism of action of covalent inhibitors [Internet]. Livro de Resumos. 2022 ;[citado 2025 nov. 07 ] Available from: https://repositorio.usp.br/directbitstream/91f0655c-30cf-45d4-ab03-731ea11970ad/P22199.pdf
Vancouver
Bonatto V, Lameira J, Luque FJ, Montanari CA. A new strategy to model the mechanism of action of covalent inhibitors [Internet]. Livro de Resumos. 2022 ;[citado 2025 nov. 07 ] Available from: https://repositorio.usp.br/directbitstream/91f0655c-30cf-45d4-ab03-731ea11970ad/P22199.pdf
Artigo de periodico
Relativistic adapted Gaussian basis sets free of variational prolapse of small and medium size for hydrogen through xenon (2022)
Gusmão, Eriosvaldo Florentino ; Haiduke, Roberto Luiz Andrade
Source: Journal of Computational Chemistry. Unidade: IQSC
Subjects: ESTRUTURA ELETRÔNICA, HIDROGÊNIO, XENÔNIO
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ABNT
GUSMÃO, Eriosvaldo Florentino e HAIDUKE, Roberto Luiz Andrade. Relativistic adapted Gaussian basis sets free of variational prolapse of small and medium size for hydrogen through xenon. Journal of Computational Chemistry, p. 1-10, 2022Tradução . . Disponível em: https://doi.org/10.1002/jcc.26990. Acesso em: 07 nov. 2025.
APA
Gusmão, E. F., & Haiduke, R. L. A. (2022). Relativistic adapted Gaussian basis sets free of variational prolapse of small and medium size for hydrogen through xenon. Journal of Computational Chemistry, 1-10. doi:10.1002/jcc.26990
NLM
Gusmão EF, Haiduke RLA. Relativistic adapted Gaussian basis sets free of variational prolapse of small and medium size for hydrogen through xenon [Internet]. Journal of Computational Chemistry. 2022 ;1-10.[citado 2025 nov. 07 ] Available from: https://doi.org/10.1002/jcc.26990
Vancouver
Gusmão EF, Haiduke RLA. Relativistic adapted Gaussian basis sets free of variational prolapse of small and medium size for hydrogen through xenon [Internet]. Journal of Computational Chemistry. 2022 ;1-10.[citado 2025 nov. 07 ] Available from: https://doi.org/10.1002/jcc.26990
Trabalho de evento-resumo
Electronic structure of self-assembled monolayers modified with ferrocene on a gold surface: evidence of electron tunneling (2015)
Lima, Filipe Camargo Dalmatti Alves; Caldas, Marilia Junqueira ; Petrilli, Helena Maria; Calzolari, Arrigo; Iost, Rodrigo Michelin ; Crespilho, Frank Nelson
Source: Resumo. Conference titles: Encontro Nacional de Física da Matéria Condensada. Unidades: IF, IQSC
Subjects: FÍSICA DA MATÉRIA CONDENSADA, ESTRUTURA ELETRÔNICA
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ABNT
LIMA, Filipe Camargo Dalmatti Alves et al. Electronic structure of self-assembled monolayers modified with ferrocene on a gold surface: evidence of electron tunneling. 2015, Anais.. São Paulo: SBF, 2015. Disponível em: http://www1.sbfisica.org.br/eventos/enfmc/xxxviii/sys/resumos/R1191-2.pdf. Acesso em: 07 nov. 2025.
APA
Lima, F. C. D. A., Caldas, M. J., Petrilli, H. M., Calzolari, A., Iost, R. M., & Crespilho, F. N. (2015). Electronic structure of self-assembled monolayers modified with ferrocene on a gold surface: evidence of electron tunneling. In Resumo. São Paulo: SBF. Recuperado de http://www1.sbfisica.org.br/eventos/enfmc/xxxviii/sys/resumos/R1191-2.pdf
NLM
Lima FCDA, Caldas MJ, Petrilli HM, Calzolari A, Iost RM, Crespilho FN. Electronic structure of self-assembled monolayers modified with ferrocene on a gold surface: evidence of electron tunneling [Internet]. Resumo. 2015 ;[citado 2025 nov. 07 ] Available from: http://www1.sbfisica.org.br/eventos/enfmc/xxxviii/sys/resumos/R1191-2.pdf
Vancouver
Lima FCDA, Caldas MJ, Petrilli HM, Calzolari A, Iost RM, Crespilho FN. Electronic structure of self-assembled monolayers modified with ferrocene on a gold surface: evidence of electron tunneling [Internet]. Resumo. 2015 ;[citado 2025 nov. 07 ] Available from: http://www1.sbfisica.org.br/eventos/enfmc/xxxviii/sys/resumos/R1191-2.pdf
Trabalho de evento-resumo periodico
Electron Transfer Mechanism in Gold Surface Modified with Self-Assembly Monolayers from First Principles (2013)
Lima, Felipe Camargo Dalmatti Alves; Iost, Rodrigo Michelin ; Crespilho, Frank Nelson ; Caldas, Marilia Junqueira ; Calzolari, Arrigo; Petrilli, Helena Maria
Source: Abstracts. Conference titles: APS March Meeting. Unidades: IQSC, IF
Subjects: MATÉRIA CONDENSADA, ESTRUTURA ELETRÔNICA
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ABNT
LIMA, Felipe Camargo Dalmatti Alves et al. Electron Transfer Mechanism in Gold Surface Modified with Self-Assembly Monolayers from First Principles. Abstracts. Maryland,: APS. Disponível em: http://absimage.aps.org/image/MAR13/MWS_MAR13-2012-002757.pdf. Acesso em: 07 nov. 2025. , 2013
APA
Lima, F. C. D. A., Iost, R. M., Crespilho, F. N., Caldas, M. J., Calzolari, A., & Petrilli, H. M. (2013). Electron Transfer Mechanism in Gold Surface Modified with Self-Assembly Monolayers from First Principles. Abstracts. Maryland,: APS. Recuperado de http://absimage.aps.org/image/MAR13/MWS_MAR13-2012-002757.pdf
NLM
Lima FCDA, Iost RM, Crespilho FN, Caldas MJ, Calzolari A, Petrilli HM. Electron Transfer Mechanism in Gold Surface Modified with Self-Assembly Monolayers from First Principles [Internet]. Abstracts. 2013 ; 58( 1):[citado 2025 nov. 07 ] Available from: http://absimage.aps.org/image/MAR13/MWS_MAR13-2012-002757.pdf
Vancouver
Lima FCDA, Iost RM, Crespilho FN, Caldas MJ, Calzolari A, Petrilli HM. Electron Transfer Mechanism in Gold Surface Modified with Self-Assembly Monolayers from First Principles [Internet]. Abstracts. 2013 ; 58( 1):[citado 2025 nov. 07 ] Available from: http://absimage.aps.org/image/MAR13/MWS_MAR13-2012-002757.pdf
Artigo de periodico
Comparative theoretical study of the electronic structures and electronic spectra of 'Fe POT.2+'-,'Fe POT.+3'-porphyrin and free base porphyrin (2001)
Oliveira, Kélson Mota Teixeira de; Trsic, Milan
Source: Journal of Molecular Structure : Theochem. Unidade: IQSC
Subjects: QUÍMICA TEÓRICA, ESTRUTURA ELETRÔNICA
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ABNT
OLIVEIRA, Kélson Mota Teixeira de e TRSIC, Milan. Comparative theoretical study of the electronic structures and electronic spectra of 'Fe POT.2+'-,'Fe POT.+3'-porphyrin and free base porphyrin. Journal of Molecular Structure : Theochem, v. 539, p. 107-117, 2001Tradução . . Acesso em: 07 nov. 2025.
APA
Oliveira, K. M. T. de, & Trsic, M. (2001). Comparative theoretical study of the electronic structures and electronic spectra of 'Fe POT.2+'-,'Fe POT.+3'-porphyrin and free base porphyrin. Journal of Molecular Structure : Theochem, 539, 107-117.
NLM
Oliveira KMT de, Trsic M. Comparative theoretical study of the electronic structures and electronic spectra of 'Fe POT.2+'-,'Fe POT.+3'-porphyrin and free base porphyrin. Journal of Molecular Structure : Theochem. 2001 ; 539 107-117.[citado 2025 nov. 07 ]
Vancouver
Oliveira KMT de, Trsic M. Comparative theoretical study of the electronic structures and electronic spectra of 'Fe POT.2+'-,'Fe POT.+3'-porphyrin and free base porphyrin. Journal of Molecular Structure : Theochem. 2001 ; 539 107-117.[citado 2025 nov. 07 ]
Artigo de periodico
Metastable excited state and electronic structure of '[Ru'(N'H IND.3') IND.5'NO] POT.3+' and '[Ru'(N'H IND.3') IND.4'(OH)NO] POT.2+' (1999)
Silva, Sebastião Claudino da; Franco, Douglas Wagner
Source: Spectrochimica Acta. Part A. Unidade: IQSC
Subjects: QUÍMICA, RUTÊNIO, ESTRUTURA ELETRÔNICA
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ABNT
SILVA, Sebastião Claudino da e FRANCO, Douglas Wagner. Metastable excited state and electronic structure of '[Ru'(N'H IND.3') IND.5'NO] POT.3+' and '[Ru'(N'H IND.3') IND.4'(OH)NO] POT.2+'. Spectrochimica Acta. Part A, v. 55, p. 1515-1525, 1999Tradução . . Acesso em: 07 nov. 2025.
APA
Silva, S. C. da, & Franco, D. W. (1999). Metastable excited state and electronic structure of '[Ru'(N'H IND.3') IND.5'NO] POT.3+' and '[Ru'(N'H IND.3') IND.4'(OH)NO] POT.2+'. Spectrochimica Acta. Part A, 55, 1515-1525.
NLM
Silva SC da, Franco DW. Metastable excited state and electronic structure of '[Ru'(N'H IND.3') IND.5'NO] POT.3+' and '[Ru'(N'H IND.3') IND.4'(OH)NO] POT.2+'. Spectrochimica Acta. Part A. 1999 ;55 1515-1525.[citado 2025 nov. 07 ]
Vancouver
Silva SC da, Franco DW. Metastable excited state and electronic structure of '[Ru'(N'H IND.3') IND.5'NO] POT.3+' and '[Ru'(N'H IND.3') IND.4'(OH)NO] POT.2+'. Spectrochimica Acta. Part A. 1999 ;55 1515-1525.[citado 2025 nov. 07 ]

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