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Artigo de periodico
Theoretical expedition for enhancing photovoltaic performance: DFT investigation of benzo[c][1,2,5] thiadiazole-based scaffolds for organic solar cells (2024)
Khalid, Muhammad ; Sagir, Muhammad; Zahid, Muhammad; Morais, Sara Figueirêdo de Alcântara ; Saqib, Muhammad ; Ullah, Sami; Munawar, Khurram Shahzad ; Braga, Ataualpa Albert Carmo ; Assiri, Mohammed Ali
Source: Industrial and Engineering Chemistry Research. Unidade: IQ
Subjects: ENERGIA ELÉTRICA, MOLÉCULA, ENERGIA SOLAR
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ABNT
KHALID, Muhammad et al. Theoretical expedition for enhancing photovoltaic performance: DFT investigation of benzo[c][1,2,5] thiadiazole-based scaffolds for organic solar cells. Industrial and Engineering Chemistry Research, v. 63, n. 6, p. 2726–2739, 2024Tradução . . Disponível em: https://dx.doi.org/10.1021/acs.iecr.3c04133. Acesso em: 26 jun. 2024.
APA
Khalid, M., Sagir, M., Zahid, M., Morais, S. F. de A., Saqib, M., Ullah, S., et al. (2024). Theoretical expedition for enhancing photovoltaic performance: DFT investigation of benzo[c][1,2,5] thiadiazole-based scaffolds for organic solar cells. Industrial and Engineering Chemistry Research, 63( 6), 2726–2739. doi:10.1021/acs.iecr.3c04133
NLM
Khalid M, Sagir M, Zahid M, Morais SF de A, Saqib M, Ullah S, Munawar KS, Braga AAC, Assiri MA. Theoretical expedition for enhancing photovoltaic performance: DFT investigation of benzo[c][1,2,5] thiadiazole-based scaffolds for organic solar cells [Internet]. Industrial and Engineering Chemistry Research. 2024 ; 63( 6): 2726–2739.[citado 2024 jun. 26 ] Available from: https://dx.doi.org/10.1021/acs.iecr.3c04133
Vancouver
Khalid M, Sagir M, Zahid M, Morais SF de A, Saqib M, Ullah S, Munawar KS, Braga AAC, Assiri MA. Theoretical expedition for enhancing photovoltaic performance: DFT investigation of benzo[c][1,2,5] thiadiazole-based scaffolds for organic solar cells [Internet]. Industrial and Engineering Chemistry Research. 2024 ; 63( 6): 2726–2739.[citado 2024 jun. 26 ] Available from: https://dx.doi.org/10.1021/acs.iecr.3c04133
Artigo de periodico
A theoretical approach towards designing of banana shaped non‑fullerene chromophores using efficient acceptors moieties: exploration of their NLO response properties (2023)
Khalid, Muhammad ; Naseer, Samran; Tahir, Muhammad Suleman; Shafiq, Iqra ; Munawar, Khurram Shahzad ; Morais, Sara Figueirêdo de Alcântara ; Braga, Ataualpa Albert Carmo
Source: Optical and Quantum Electronics. Unidade: IQ
Assunto: MATERIAIS ÓPTICOS
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ABNT
KHALID, Muhammad et al. A theoretical approach towards designing of banana shaped non‑fullerene chromophores using efficient acceptors moieties: exploration of their NLO response properties. Optical and Quantum Electronics, v. 55, p. 1-23, 2023Tradução . . Disponível em: https://doi.org/10.1007/s11082-022-04441-w. Acesso em: 26 jun. 2024.
APA
Khalid, M., Naseer, S., Tahir, M. S., Shafiq, I., Munawar, K. S., Morais, S. F. de A., & Braga, A. A. C. (2023). A theoretical approach towards designing of banana shaped non‑fullerene chromophores using efficient acceptors moieties: exploration of their NLO response properties. Optical and Quantum Electronics, 55, 1-23. doi:10.1007/s11082-022-04441-w
NLM
Khalid M, Naseer S, Tahir MS, Shafiq I, Munawar KS, Morais SF de A, Braga AAC. A theoretical approach towards designing of banana shaped non‑fullerene chromophores using efficient acceptors moieties: exploration of their NLO response properties [Internet]. Optical and Quantum Electronics. 2023 ; 55 1-23.[citado 2024 jun. 26 ] Available from: https://doi.org/10.1007/s11082-022-04441-w
Vancouver
Khalid M, Naseer S, Tahir MS, Shafiq I, Munawar KS, Morais SF de A, Braga AAC. A theoretical approach towards designing of banana shaped non‑fullerene chromophores using efficient acceptors moieties: exploration of their NLO response properties [Internet]. Optical and Quantum Electronics. 2023 ; 55 1-23.[citado 2024 jun. 26 ] Available from: https://doi.org/10.1007/s11082-022-04441-w
Artigo de periodico
The impact of structural modifications into benzodithiophene compounds on electronic and optical properties for organic solar cells (2023)
Shafiq, Iqra ; Khalid, Muhammad; Muneer, Malaika; Asghar, Muhammad Adnan ; Baby, Rabia; Ahmed, Sarfraz ; Ahamad, Tansir; Morais, Sara Figueirêdo de Alcântara ; Braga, Ataualpa Albert Carmo
Source: Materials Chemistry and Physics. Unidade: IQ
Subjects: CÉLULAS SOLARES, PROPRIEDADES ÓPTICAS DA SOLUÇÃO, FULERENO
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SHAFIQ, Iqra et al. The impact of structural modifications into benzodithiophene compounds on electronic and optical properties for organic solar cells. Materials Chemistry and Physics, v. 308, p. 1-13 art. 128154, 2023Tradução . . Disponível em: https://doi.org/10.1016/j.matchemphys.2023.128154. Acesso em: 26 jun. 2024.
APA
Shafiq, I., Khalid, M., Muneer, M., Asghar, M. A., Baby, R., Ahmed, S., et al. (2023). The impact of structural modifications into benzodithiophene compounds on electronic and optical properties for organic solar cells. Materials Chemistry and Physics, 308, 1-13 art. 128154. doi:10.1016/j.matchemphys.2023.128154
NLM
Shafiq I, Khalid M, Muneer M, Asghar MA, Baby R, Ahmed S, Ahamad T, Morais SF de A, Braga AAC. The impact of structural modifications into benzodithiophene compounds on electronic and optical properties for organic solar cells [Internet]. Materials Chemistry and Physics. 2023 ; 308 1-13 art. 128154.[citado 2024 jun. 26 ] Available from: https://doi.org/10.1016/j.matchemphys.2023.128154
Vancouver
Shafiq I, Khalid M, Muneer M, Asghar MA, Baby R, Ahmed S, Ahamad T, Morais SF de A, Braga AAC. The impact of structural modifications into benzodithiophene compounds on electronic and optical properties for organic solar cells [Internet]. Materials Chemistry and Physics. 2023 ; 308 1-13 art. 128154.[citado 2024 jun. 26 ] Available from: https://doi.org/10.1016/j.matchemphys.2023.128154
Artigo de periodico
A coumarin based Schiff Base: an effective colorimetric sensor for selective detection of F– ion in real samples and DFT studies (2023)
Ahmed, Nadeem; Zareen, Wajeeha; Shafiq, Zahid ; Morais, Sara Figueirêdo de Alcântara ; Khalid, Muhammad ; Braga, Ataualpa Albert Carmo ; Munawar, Khurram Shahzad ; Yong, Ye
Source: Spectrochimica Acta Part A. Unidade: IQ
Subjects: CIRCUITOS LÓGICOS, ÍONS
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ABNT
AHMED, Nadeem et al. A coumarin based Schiff Base: an effective colorimetric sensor for selective detection of F– ion in real samples and DFT studies. Spectrochimica Acta Part A, v. 286, p. 1-13 art. 121964, 2023Tradução . . Disponível em: https://doi.org/10.1016/j.saa.2022.121964. Acesso em: 26 jun. 2024.
APA
Ahmed, N., Zareen, W., Shafiq, Z., Morais, S. F. de A., Khalid, M., Braga, A. A. C., et al. (2023). A coumarin based Schiff Base: an effective colorimetric sensor for selective detection of F– ion in real samples and DFT studies. Spectrochimica Acta Part A, 286, 1-13 art. 121964. doi:10.1016/j.saa.2022.121964
NLM
Ahmed N, Zareen W, Shafiq Z, Morais SF de A, Khalid M, Braga AAC, Munawar KS, Yong Y. A coumarin based Schiff Base: an effective colorimetric sensor for selective detection of F– ion in real samples and DFT studies [Internet]. Spectrochimica Acta Part A. 2023 ; 286 1-13 art. 121964.[citado 2024 jun. 26 ] Available from: https://doi.org/10.1016/j.saa.2022.121964
Vancouver
Ahmed N, Zareen W, Shafiq Z, Morais SF de A, Khalid M, Braga AAC, Munawar KS, Yong Y. A coumarin based Schiff Base: an effective colorimetric sensor for selective detection of F– ion in real samples and DFT studies [Internet]. Spectrochimica Acta Part A. 2023 ; 286 1-13 art. 121964.[citado 2024 jun. 26 ] Available from: https://doi.org/10.1016/j.saa.2022.121964
Artigo de periodico
Enriching NLO efficacy via designing non-fullerene molecules with the modification of acceptor moieties into ICIF2F: an emerging theoretical approach (2022)
Khalid, Muhammad ; Arshad, Muhammad Nadeem ; Murtaza, Shahzad ; Shafiq, Iqra ; Haroon, Muhammad; Asiri, Abdullah M ; Morais, Sara Figueirêdo de Alcântara ; Braga, Ataualpa Albert Carmo
Source: RSC-advances. Unidade: IQ
Subjects: MATERIAIS ÓPTICOS, FIBRA ÓPTICA
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ABNT
KHALID, Muhammad et al. Enriching NLO efficacy via designing non-fullerene molecules with the modification of acceptor moieties into ICIF2F: an emerging theoretical approach. RSC-advances, v. 12, p. 13412–13427, 2022Tradução . . Disponível em: https://doi.org/10.1039/d2ra01127a. Acesso em: 26 jun. 2024.
APA
Khalid, M., Arshad, M. N., Murtaza, S., Shafiq, I., Haroon, M., Asiri, A. M., et al. (2022). Enriching NLO efficacy via designing non-fullerene molecules with the modification of acceptor moieties into ICIF2F: an emerging theoretical approach. RSC-advances, 12, 13412–13427. doi:10.1039/d2ra01127a
NLM
Khalid M, Arshad MN, Murtaza S, Shafiq I, Haroon M, Asiri AM, Morais SF de A, Braga AAC. Enriching NLO efficacy via designing non-fullerene molecules with the modification of acceptor moieties into ICIF2F: an emerging theoretical approach [Internet]. RSC-advances. 2022 ; 12 13412–13427.[citado 2024 jun. 26 ] Available from: https://doi.org/10.1039/d2ra01127a
Vancouver
Khalid M, Arshad MN, Murtaza S, Shafiq I, Haroon M, Asiri AM, Morais SF de A, Braga AAC. Enriching NLO efficacy via designing non-fullerene molecules with the modification of acceptor moieties into ICIF2F: an emerging theoretical approach [Internet]. RSC-advances. 2022 ; 12 13412–13427.[citado 2024 jun. 26 ] Available from: https://doi.org/10.1039/d2ra01127a
Artigo de periodico
Understanding the reaction mechanism of the CO2 and cyclohexene oxide copolymerization catalyzed by zinc(II) and magnesium(II) catalysts: a DFT approach (2022)
Lima, Lucas Welington de ; Morais, Sara Figueirêdo de Alcântara ; Braga, Ataualpa Albert Carmo
Source: Journal of Molecular Modeling. Unidade: IQ
Subjects: CATALISADORES, ZINCO
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ABNT
LIMA, Lucas Welington de e MORAIS, Sara Figueirêdo de Alcântara e BRAGA, Ataualpa Albert Carmo. Understanding the reaction mechanism of the CO2 and cyclohexene oxide copolymerization catalyzed by zinc(II) and magnesium(II) catalysts: a DFT approach. Journal of Molecular Modeling, v. 28, p. 1-13 art. 314, 2022Tradução . . Disponível em: https://doi.org/10.21203/rs.3.rs-1713986/v1. Acesso em: 26 jun. 2024.
APA
Lima, L. W. de, Morais, S. F. de A., & Braga, A. A. C. (2022). Understanding the reaction mechanism of the CO2 and cyclohexene oxide copolymerization catalyzed by zinc(II) and magnesium(II) catalysts: a DFT approach. Journal of Molecular Modeling, 28, 1-13 art. 314. doi:10.21203/rs.3.rs-1713986/v1
NLM
Lima LW de, Morais SF de A, Braga AAC. Understanding the reaction mechanism of the CO2 and cyclohexene oxide copolymerization catalyzed by zinc(II) and magnesium(II) catalysts: a DFT approach [Internet]. Journal of Molecular Modeling. 2022 ; 28 1-13 art. 314.[citado 2024 jun. 26 ] Available from: https://doi.org/10.21203/rs.3.rs-1713986/v1
Vancouver
Lima LW de, Morais SF de A, Braga AAC. Understanding the reaction mechanism of the CO2 and cyclohexene oxide copolymerization catalyzed by zinc(II) and magnesium(II) catalysts: a DFT approach [Internet]. Journal of Molecular Modeling. 2022 ; 28 1-13 art. 314.[citado 2024 jun. 26 ] Available from: https://doi.org/10.21203/rs.3.rs-1713986/v1
Artigo de periodico
Preparation, QTAIM and single-crystal exploration of the Pyrimethamine-based co-crystal salts with substituted benzoic acids (2022)
Ali, Akbar ; Khalid, Muhammad; Ashfaq, Muhammad; Malik, Abida Naseem; Muhammad Nawaz Tahir; Assiri, Mohammed A; Imran, Muhammad; Morais, Sara Figueirêdo de Alcântara ; Braga, Ataualpa Albert Carmo
Source: ChemistrySelect. Unidade: IQ
Subjects: DOENÇAS INFECCIOSAS, MALÁRIA, SAIS, QUÍMICA ORGÂNICA, QUÍMICA SUPRAMOLECULAR
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ABNT
ALI, Akbar et al. Preparation, QTAIM and single-crystal exploration of the Pyrimethamine-based co-crystal salts with substituted benzoic acids. ChemistrySelect, v. 7, p. 1-13 art. e202200349, 2022Tradução . . Disponível em: https://doi.org/10.1002/slct.202200349. Acesso em: 26 jun. 2024.
APA
Ali, A., Khalid, M., Ashfaq, M., Malik, A. N., Muhammad Nawaz Tahir,, Assiri, M. A., et al. (2022). Preparation, QTAIM and single-crystal exploration of the Pyrimethamine-based co-crystal salts with substituted benzoic acids. ChemistrySelect, 7, 1-13 art. e202200349. doi:10.1002/slct.202200349
NLM
Ali A, Khalid M, Ashfaq M, Malik AN, Muhammad Nawaz Tahir, Assiri MA, Imran M, Morais SF de A, Braga AAC. Preparation, QTAIM and single-crystal exploration of the Pyrimethamine-based co-crystal salts with substituted benzoic acids [Internet]. ChemistrySelect. 2022 ; 7 1-13 art. e202200349.[citado 2024 jun. 26 ] Available from: https://doi.org/10.1002/slct.202200349
Vancouver
Ali A, Khalid M, Ashfaq M, Malik AN, Muhammad Nawaz Tahir, Assiri MA, Imran M, Morais SF de A, Braga AAC. Preparation, QTAIM and single-crystal exploration of the Pyrimethamine-based co-crystal salts with substituted benzoic acids [Internet]. ChemistrySelect. 2022 ; 7 1-13 art. e202200349.[citado 2024 jun. 26 ] Available from: https://doi.org/10.1002/slct.202200349
Artigo de periodico
2-Nitro- and 4-fluorocinnamaldehyde based receptors as naked-eye chemosensors to potential molecular keypad lock (2021)
Islam, Muhammad; Shafiq, Zahid ; Mabood, Fazal; Shah, Hakikulla H; Singh, Vandita; Khalid, Muhammad ; Morais, Sara Figueirêdo de Alcântara ; Braga, Ataualpa Albert Carmo ; Khan, Muhammad Usman ; Hussain, Javid; Al-Harrasi, Ahmed; Marraiki, Najat; Zaghloul, Nouf S. S
Source: Scientific Reports. Unidade: IQ
Subjects: RECEPTORES, MOLÉCULA
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ABNT
ISLAM, Muhammad et al. 2-Nitro- and 4-fluorocinnamaldehyde based receptors as naked-eye chemosensors to potential molecular keypad lock. Scientific Reports, v. 11, p. 1-24 art. 20847, 2021Tradução . . Disponível em: https://doi.org/10.1038/s41598-021-99599-w. Acesso em: 26 jun. 2024.
APA
Islam, M., Shafiq, Z., Mabood, F., Shah, H. H., Singh, V., Khalid, M., et al. (2021). 2-Nitro- and 4-fluorocinnamaldehyde based receptors as naked-eye chemosensors to potential molecular keypad lock. Scientific Reports, 11, 1-24 art. 20847. doi:10.1038/s41598-021-99599-w
NLM
Islam M, Shafiq Z, Mabood F, Shah HH, Singh V, Khalid M, Morais SF de A, Braga AAC, Khan MU, Hussain J, Al-Harrasi A, Marraiki N, Zaghloul NSS. 2-Nitro- and 4-fluorocinnamaldehyde based receptors as naked-eye chemosensors to potential molecular keypad lock [Internet]. Scientific Reports. 2021 ; 11 1-24 art. 20847.[citado 2024 jun. 26 ] Available from: https://doi.org/10.1038/s41598-021-99599-w
Vancouver
Islam M, Shafiq Z, Mabood F, Shah HH, Singh V, Khalid M, Morais SF de A, Braga AAC, Khan MU, Hussain J, Al-Harrasi A, Marraiki N, Zaghloul NSS. 2-Nitro- and 4-fluorocinnamaldehyde based receptors as naked-eye chemosensors to potential molecular keypad lock [Internet]. Scientific Reports. 2021 ; 11 1-24 art. 20847.[citado 2024 jun. 26 ] Available from: https://doi.org/10.1038/s41598-021-99599-w
Artigo de periodico
Non-covalent interactions abetted supramolecular arrangements of N -Substitute d b enzylidene acetohydrazide to direct its solid-state network (2021)
Khalid, Muhammad ; Ali, Akbar ; Khan, Muhammad Usman ; Tahir, Muhammad Nawaz; Ahmad, Anees ; Ashfaq, Muhammad; Hussain, Riaz; Morais, Sara Figueirêdo de Alcântara ; Braga, Ataualpa Albert Carmo
Source: Journal of Molecular Structure. Unidades: IQ, IQSC
Subjects: QUÍMICA ORGÂNICA, SÍNTESE ORGÂNICA
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ABNT
KHALID, Muhammad et al. Non-covalent interactions abetted supramolecular arrangements of N -Substitute d b enzylidene acetohydrazide to direct its solid-state network. Journal of Molecular Structure, v. 1230 p. 129827, 2021Tradução . . Disponível em: https://doi.org/10.1016/j.molstruc.2020.129827. Acesso em: 26 jun. 2024.
APA
Khalid, M., Ali, A., Khan, M. U., Tahir, M. N., Ahmad, A., Ashfaq, M., et al. (2021). Non-covalent interactions abetted supramolecular arrangements of N -Substitute d b enzylidene acetohydrazide to direct its solid-state network. Journal of Molecular Structure, 1230 p. 129827. doi:10.1016/j.molstruc.2020.129827
NLM
Khalid M, Ali A, Khan MU, Tahir MN, Ahmad A, Ashfaq M, Hussain R, Morais SF de A, Braga AAC. Non-covalent interactions abetted supramolecular arrangements of N -Substitute d b enzylidene acetohydrazide to direct its solid-state network [Internet]. Journal of Molecular Structure. 2021 ; 1230 p. 129827[citado 2024 jun. 26 ] Available from: https://doi.org/10.1016/j.molstruc.2020.129827
Vancouver
Khalid M, Ali A, Khan MU, Tahir MN, Ahmad A, Ashfaq M, Hussain R, Morais SF de A, Braga AAC. Non-covalent interactions abetted supramolecular arrangements of N -Substitute d b enzylidene acetohydrazide to direct its solid-state network [Internet]. Journal of Molecular Structure. 2021 ; 1230 p. 129827[citado 2024 jun. 26 ] Available from: https://doi.org/10.1016/j.molstruc.2020.129827
Artigo de periodico
DFT study of H2 adsorption at a Cu-SSZ-13 zeolite: a cluster approach (2021)
Mounssef Junior, Bassim ; Morais, Sara Figueirêdo de Alcântara ; Batista, Ana Paula de Lima ; Lima, Lucas Welington de ; Braga, Ataualpa Albert Carmo
Source: Physical Chemistry Chemical Physics. Unidades: IQ, FFCLRP
Subjects: HIDROGÊNIO, ADSORÇÃO, MINERAIS
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ABNT
MOUNSSEF JUNIOR, Bassim et al. DFT study of H2 adsorption at a Cu-SSZ-13 zeolite: a cluster approach. Physical Chemistry Chemical Physics, v. 23, p. 1-11 art. 9980–9990 : + Supplementary materials ( S1-S11), 2021Tradução . . Disponível em: https://doi.org/10.1039/d1cp00422k. Acesso em: 26 jun. 2024.
APA
Mounssef Junior, B., Morais, S. F. de A., Batista, A. P. de L., Lima, L. W. de, & Braga, A. A. C. (2021). DFT study of H2 adsorption at a Cu-SSZ-13 zeolite: a cluster approach. Physical Chemistry Chemical Physics, 23, 1-11 art. 9980–9990 : + Supplementary materials ( S1-S11). doi:10.1039/d1cp00422k
NLM
Mounssef Junior B, Morais SF de A, Batista AP de L, Lima LW de, Braga AAC. DFT study of H2 adsorption at a Cu-SSZ-13 zeolite: a cluster approach [Internet]. Physical Chemistry Chemical Physics. 2021 ; 23 1-11 art. 9980–9990 : + Supplementary materials ( S1-S11).[citado 2024 jun. 26 ] Available from: https://doi.org/10.1039/d1cp00422k
Vancouver
Mounssef Junior B, Morais SF de A, Batista AP de L, Lima LW de, Braga AAC. DFT study of H2 adsorption at a Cu-SSZ-13 zeolite: a cluster approach [Internet]. Physical Chemistry Chemical Physics. 2021 ; 23 1-11 art. 9980–9990 : + Supplementary materials ( S1-S11).[citado 2024 jun. 26 ] Available from: https://doi.org/10.1039/d1cp00422k
Artigo de periodico
3,4-Methylenedioxypyrovalerone (MDPV) sensing based on electropolymerized molecularly imprinted polymers on silver nanoparticles and carboxylated multi-walled carbon nanotubes (2021)
Couto, Rosa A. S ; Coelho, Constantino; Mounssef Junior, Bassim; Morais, Sara Figueirêdo de Alcântara ; Lima, Camila D; Santos, Wallans Torres Pio dos ; Carvalho, Félix ; Rodrigues, Cecília M. P ; Braga, Ataualpa Albert Carmo ; Gonçalves, Luís Moreira ; Quinaz, M. Beatriz
Source: Nanomaterials. Unidade: IQ
Subjects: NANOTUBOS, NANOPARTÍCULAS, PRATA, CARBONO, QUÍMICA ANALÍTICA, QUÍMICA FORÊNSICA
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ABNT
COUTO, Rosa A. S et al. 3,4-Methylenedioxypyrovalerone (MDPV) sensing based on electropolymerized molecularly imprinted polymers on silver nanoparticles and carboxylated multi-walled carbon nanotubes. Nanomaterials, v. 11, p. 1-18 art. 353 : + Supplementary materials ( S1-S5), 2021Tradução . . Disponível em: https://doi.org/10.3390/nano11020353. Acesso em: 26 jun. 2024.
APA
Couto, R. A. S., Coelho, C., Mounssef Junior, B., Morais, S. F. de A., Lima, C. D., Santos, W. T. P. dos, et al. (2021). 3,4-Methylenedioxypyrovalerone (MDPV) sensing based on electropolymerized molecularly imprinted polymers on silver nanoparticles and carboxylated multi-walled carbon nanotubes. Nanomaterials, 11, 1-18 art. 353 : + Supplementary materials ( S1-S5). doi:10.3390/nano11020353
NLM
Couto RAS, Coelho C, Mounssef Junior B, Morais SF de A, Lima CD, Santos WTP dos, Carvalho F, Rodrigues CMP, Braga AAC, Gonçalves LM, Quinaz MB. 3,4-Methylenedioxypyrovalerone (MDPV) sensing based on electropolymerized molecularly imprinted polymers on silver nanoparticles and carboxylated multi-walled carbon nanotubes [Internet]. Nanomaterials. 2021 ; 11 1-18 art. 353 : + Supplementary materials ( S1-S5).[citado 2024 jun. 26 ] Available from: https://doi.org/10.3390/nano11020353
Vancouver
Couto RAS, Coelho C, Mounssef Junior B, Morais SF de A, Lima CD, Santos WTP dos, Carvalho F, Rodrigues CMP, Braga AAC, Gonçalves LM, Quinaz MB. 3,4-Methylenedioxypyrovalerone (MDPV) sensing based on electropolymerized molecularly imprinted polymers on silver nanoparticles and carboxylated multi-walled carbon nanotubes [Internet]. Nanomaterials. 2021 ; 11 1-18 art. 353 : + Supplementary materials ( S1-S5).[citado 2024 jun. 26 ] Available from: https://doi.org/10.3390/nano11020353
Artigo de periodico
Prediction of 15N NMR chemical shifts for nitrogenated aromatic compounds (2020)
Oliveira, Marcelo Tavares de; Alves, Júlia Maria Aragon; Morais, Sara Figueirêdo de Alcântara ; Braga, Ataualpa Albert Carmo
Source: ARKIVOC - Archive for Organic Chemistry. Unidades: IQ, IQSC
Subjects: QUÍMICA ORGÂNICA, RESSONÂNCIA MAGNÉTICA NUCLEAR
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ABNT
OLIVEIRA, Marcelo Tavares de et al. Prediction of 15N NMR chemical shifts for nitrogenated aromatic compounds. ARKIVOC - Archive for Organic Chemistry, p. 113-122, 2020Tradução . . Disponível em: https://doi.org/10.24820/ark.5550190.p011.135. Acesso em: 26 jun. 2024.
APA
Oliveira, M. T. de, Alves, J. M. A., Morais, S. F. de A., & Braga, A. A. C. (2020). Prediction of 15N NMR chemical shifts for nitrogenated aromatic compounds. ARKIVOC - Archive for Organic Chemistry, 113-122. doi:10.24820/ark.5550190.p011.135
NLM
Oliveira MT de, Alves JMA, Morais SF de A, Braga AAC. Prediction of 15N NMR chemical shifts for nitrogenated aromatic compounds [Internet]. ARKIVOC - Archive for Organic Chemistry. 2020 ; 113-122.[citado 2024 jun. 26 ] Available from: https://doi.org/10.24820/ark.5550190.p011.135
Vancouver
Oliveira MT de, Alves JMA, Morais SF de A, Braga AAC. Prediction of 15N NMR chemical shifts for nitrogenated aromatic compounds [Internet]. ARKIVOC - Archive for Organic Chemistry. 2020 ; 113-122.[citado 2024 jun. 26 ] Available from: https://doi.org/10.24820/ark.5550190.p011.135
Artigo de periodico
2-Amino-3-methylpyridinium, 2-amino-4-methylbenzothiazolium and 2-amino-5-chloropyridinium salts. experimental and theoretical findings (2020)
Hanif, Muhammad; Khan, Ezzat ; Tahir, Muhammad Nawaz; Morais, Sara Figueirêdo de Alcântara ; Braga, Ataualpa Albert Carmo
Source: Journal of Molecular Structure. Unidade: IQ
Subjects: SAIS, ÁCIDOS
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ABNT
HANIF, Muhammad et al. 2-Amino-3-methylpyridinium, 2-amino-4-methylbenzothiazolium and 2-amino-5-chloropyridinium salts. experimental and theoretical findings. Journal of Molecular Structure, v. 1222, p. 1-16 art. 128914, 2020Tradução . . Disponível em: https://doi.org/10.1016/j.molstruc.2020.128914. Acesso em: 26 jun. 2024.
APA
Hanif, M., Khan, E., Tahir, M. N., Morais, S. F. de A., & Braga, A. A. C. (2020). 2-Amino-3-methylpyridinium, 2-amino-4-methylbenzothiazolium and 2-amino-5-chloropyridinium salts. experimental and theoretical findings. Journal of Molecular Structure, 1222, 1-16 art. 128914. doi:10.1016/j.molstruc.2020.128914
NLM
Hanif M, Khan E, Tahir MN, Morais SF de A, Braga AAC. 2-Amino-3-methylpyridinium, 2-amino-4-methylbenzothiazolium and 2-amino-5-chloropyridinium salts. experimental and theoretical findings [Internet]. Journal of Molecular Structure. 2020 ; 1222 1-16 art. 128914.[citado 2024 jun. 26 ] Available from: https://doi.org/10.1016/j.molstruc.2020.128914
Vancouver
Hanif M, Khan E, Tahir MN, Morais SF de A, Braga AAC. 2-Amino-3-methylpyridinium, 2-amino-4-methylbenzothiazolium and 2-amino-5-chloropyridinium salts. experimental and theoretical findings [Internet]. Journal of Molecular Structure. 2020 ; 1222 1-16 art. 128914.[citado 2024 jun. 26 ] Available from: https://doi.org/10.1016/j.molstruc.2020.128914
Artigo de periodico
A facile microwave assisted synthesis and structure elucidation of (3R)-3-alkyl-4,1-benzoxazepine-2,5-diones by crystallographic, spectroscopic and DFT studies (2020)
Raza, Abdul Rauf; Nisar, Bushra; Khalid, Muhammad ; Gondal, Humaira Yasmeen; Khan, Muhammad Usman ; Morais, Sara Figueirêdo de Alcântara ; Tahir, Muhammad Nawaz; Braga, Ataualpa Albert Carmo
Source: Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy. Unidade: IQ
Subjects: TECNOLOGIA DE MICRO-ONDAS, IRRADIAÇÃO
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
RAZA, Abdul Rauf et al. A facile microwave assisted synthesis and structure elucidation of (3R)-3-alkyl-4,1-benzoxazepine-2,5-diones by crystallographic, spectroscopic and DFT studies. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, v. 230, p. 1-15 art. 117995, 2020Tradução . . Disponível em: https://doi.org/10.1016/j.saa.2019.117995. Acesso em: 26 jun. 2024.
APA
Raza, A. R., Nisar, B., Khalid, M., Gondal, H. Y., Khan, M. U., Morais, S. F. de A., et al. (2020). A facile microwave assisted synthesis and structure elucidation of (3R)-3-alkyl-4,1-benzoxazepine-2,5-diones by crystallographic, spectroscopic and DFT studies. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy, 230, 1-15 art. 117995. doi:10.1016/j.saa.2019.117995
NLM
Raza AR, Nisar B, Khalid M, Gondal HY, Khan MU, Morais SF de A, Tahir MN, Braga AAC. A facile microwave assisted synthesis and structure elucidation of (3R)-3-alkyl-4,1-benzoxazepine-2,5-diones by crystallographic, spectroscopic and DFT studies [Internet]. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy. 2020 ; 230 1-15 art. 117995.[citado 2024 jun. 26 ] Available from: https://doi.org/10.1016/j.saa.2019.117995
Vancouver
Raza AR, Nisar B, Khalid M, Gondal HY, Khan MU, Morais SF de A, Tahir MN, Braga AAC. A facile microwave assisted synthesis and structure elucidation of (3R)-3-alkyl-4,1-benzoxazepine-2,5-diones by crystallographic, spectroscopic and DFT studies [Internet]. Spectrochimica Acta Part A: Molecular and Biomolecular Spectroscopy. 2020 ; 230 1-15 art. 117995.[citado 2024 jun. 26 ] Available from: https://doi.org/10.1016/j.saa.2019.117995
Artigo de periodico
Experimental and computational investigations of new indole derivatives: a combined spectroscopic, SC-XRD, DFT/TD-DFT and QTAIM analysis (2020)
Tariq, Sobia; Khalid, Muhammad ; Raza, Abdul Rauf; Rubab, Syeda Laila; Morais, Sara Figueirêdo de Alcântara ; Khan, Muhammad Usman ; Tahir, Muhammad Nawaz; Braga, Ataualpa Albert Carmo
Source: Journal of Molecular Structure. Unidade: IQ
Subjects: ANÁLISE ESPECTROSCÓPICA, ALCALOIDES
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
TARIQ, Sobia et al. Experimental and computational investigations of new indole derivatives: a combined spectroscopic, SC-XRD, DFT/TD-DFT and QTAIM analysis. Journal of Molecular Structure, v. 1207, p. 1-16 art. 127803, 2020Tradução . . Disponível em: https://doi.org/10.1016/j.molstruc.2020.127803. Acesso em: 26 jun. 2024.
APA
Tariq, S., Khalid, M., Raza, A. R., Rubab, S. L., Morais, S. F. de A., Khan, M. U., et al. (2020). Experimental and computational investigations of new indole derivatives: a combined spectroscopic, SC-XRD, DFT/TD-DFT and QTAIM analysis. Journal of Molecular Structure, 1207, 1-16 art. 127803. doi:10.1016/j.molstruc.2020.127803
NLM
Tariq S, Khalid M, Raza AR, Rubab SL, Morais SF de A, Khan MU, Tahir MN, Braga AAC. Experimental and computational investigations of new indole derivatives: a combined spectroscopic, SC-XRD, DFT/TD-DFT and QTAIM analysis [Internet]. Journal of Molecular Structure. 2020 ; 1207 1-16 art. 127803.[citado 2024 jun. 26 ] Available from: https://doi.org/10.1016/j.molstruc.2020.127803
Vancouver
Tariq S, Khalid M, Raza AR, Rubab SL, Morais SF de A, Khan MU, Tahir MN, Braga AAC. Experimental and computational investigations of new indole derivatives: a combined spectroscopic, SC-XRD, DFT/TD-DFT and QTAIM analysis [Internet]. Journal of Molecular Structure. 2020 ; 1207 1-16 art. 127803.[citado 2024 jun. 26 ] Available from: https://doi.org/10.1016/j.molstruc.2020.127803

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