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Filtros : "Paquistão" Removidos: "SEL" "Ismail, Amir" "Rockefeller University Press" "TRABALHO DE ESPECIALIZACAO - MBA" Limpar

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  • Artigo de periodico

    Exploration the effect of selenophene moiety and benzothiophene based acceptors on optical nonlinearity of D–π–A based heterocyclic organic compounds in chloroform solvent: a DFT approach (2024)

    Shafiq, Iqra ; Braga, Ataualpa Albert Carmo ; Tariq, Zara; Alhokbany, Norah ; Chen, Ke

    Source: Journal of Molecular Liquids. Unidade: IQ

    Subjects: FULERENO, COMPOSTOS ORGÂNICOS, COMPOSTOS HETEROCÍCLICOS

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      SHAFIQ, Iqra et al. Exploration the effect of selenophene moiety and benzothiophene based acceptors on optical nonlinearity of D–π–A based heterocyclic organic compounds in chloroform solvent: a DFT approach. Journal of Molecular Liquids, v. 393, p. 1-17 art. 123569, 2024Tradução . . Disponível em: https://dx.doi.org/10.1016/j.molliq.2023.123569. Acesso em: 09 ago. 2024.

    • APA

      Shafiq, I., Braga, A. A. C., Tariq, Z., Alhokbany, N., & Chen, K. (2024). Exploration the effect of selenophene moiety and benzothiophene based acceptors on optical nonlinearity of D–π–A based heterocyclic organic compounds in chloroform solvent: a DFT approach. Journal of Molecular Liquids, 393, 1-17 art. 123569. doi:10.1016/j.molliq.2023.123569

    • NLM

      Shafiq I, Braga AAC, Tariq Z, Alhokbany N, Chen K. Exploration the effect of selenophene moiety and benzothiophene based acceptors on optical nonlinearity of D–π–A based heterocyclic organic compounds in chloroform solvent: a DFT approach [Internet]. Journal of Molecular Liquids. 2024 ; 393 1-17 art. 123569.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1016/j.molliq.2023.123569

    • Vancouver

      Shafiq I, Braga AAC, Tariq Z, Alhokbany N, Chen K. Exploration the effect of selenophene moiety and benzothiophene based acceptors on optical nonlinearity of D–π–A based heterocyclic organic compounds in chloroform solvent: a DFT approach [Internet]. Journal of Molecular Liquids. 2024 ; 393 1-17 art. 123569.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1016/j.molliq.2023.123569

  • Artigo de periodico

    Tuning the photovoltaic potential of thiazole based materials via incorporation of selenophene and electron acceptors rings at peripheral positions: a DFT approach (2024)

    Khalid, Muhammad ; Jamal, Sadia; Braga, Ataualpa Albert Carmo ; Haroon, Muhammad ; Alotaibi, Author Rajeh; Chen, Ke

    Source: Journal of Saudi Chemical Society. Unidade: IQ

    Subjects: ELÉTRONS, ENERGIA

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      KHALID, Muhammad et al. Tuning the photovoltaic potential of thiazole based materials via incorporation of selenophene and electron acceptors rings at peripheral positions: a DFT approach. Journal of Saudi Chemical Society, v. 28, p. 1-14 art. 101903, 2024Tradução . . Disponível em: https://dx.doi.org/10.1016/j.jscs.2024.101903. Acesso em: 09 ago. 2024.

    • APA

      Khalid, M., Jamal, S., Braga, A. A. C., Haroon, M., Alotaibi, A. R., & Chen, K. (2024). Tuning the photovoltaic potential of thiazole based materials via incorporation of selenophene and electron acceptors rings at peripheral positions: a DFT approach. Journal of Saudi Chemical Society, 28, 1-14 art. 101903. doi:10.1016/j.jscs.2024.101903

    • NLM

      Khalid M, Jamal S, Braga AAC, Haroon M, Alotaibi AR, Chen K. Tuning the photovoltaic potential of thiazole based materials via incorporation of selenophene and electron acceptors rings at peripheral positions: a DFT approach [Internet]. Journal of Saudi Chemical Society. 2024 ; 28 1-14 art. 101903.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1016/j.jscs.2024.101903

    • Vancouver

      Khalid M, Jamal S, Braga AAC, Haroon M, Alotaibi AR, Chen K. Tuning the photovoltaic potential of thiazole based materials via incorporation of selenophene and electron acceptors rings at peripheral positions: a DFT approach [Internet]. Journal of Saudi Chemical Society. 2024 ; 28 1-14 art. 101903.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1016/j.jscs.2024.101903

  • Artigo de periodico

    Synergistic charge-transfer dynamics of rigid fused and unfused backbone with donors lead to promising photovoltaic properties of diazaborinine-based chromophores (2024)

    khalid, Muhammad; Zafar, Maria; Shafiq, Iqra; Braga, Ataualpa Albert Carmo ; Haroon, Muhammad; Ahamad, Tansir

    Source: Materials Science in Semiconductor Processing. Unidade: IQ

    Assunto: CÉLULAS SOLARES

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      KHALID, Muhammad et al. Synergistic charge-transfer dynamics of rigid fused and unfused backbone with donors lead to promising photovoltaic properties of diazaborinine-based chromophores. Materials Science in Semiconductor Processing, v. 182, p. 1-16 art. 108695, 2024Tradução . . Disponível em: https://dx.doi.org/10.1016/j.mssp.2024.108695. Acesso em: 09 ago. 2024.

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      khalid, M., Zafar, M., Shafiq, I., Braga, A. A. C., Haroon, M., & Ahamad, T. (2024). Synergistic charge-transfer dynamics of rigid fused and unfused backbone with donors lead to promising photovoltaic properties of diazaborinine-based chromophores. Materials Science in Semiconductor Processing, 182, 1-16 art. 108695. doi:10.1016/j.mssp.2024.108695

    • NLM

      khalid M, Zafar M, Shafiq I, Braga AAC, Haroon M, Ahamad T. Synergistic charge-transfer dynamics of rigid fused and unfused backbone with donors lead to promising photovoltaic properties of diazaborinine-based chromophores [Internet]. Materials Science in Semiconductor Processing. 2024 ; 182 1-16 art. 108695.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1016/j.mssp.2024.108695

    • Vancouver

      khalid M, Zafar M, Shafiq I, Braga AAC, Haroon M, Ahamad T. Synergistic charge-transfer dynamics of rigid fused and unfused backbone with donors lead to promising photovoltaic properties of diazaborinine-based chromophores [Internet]. Materials Science in Semiconductor Processing. 2024 ; 182 1-16 art. 108695.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1016/j.mssp.2024.108695

  • Artigo de periodico

    Influence of acceptors on the optical nonlinearity of 5H-4-oxa-1,6,9-trithia-cyclopenta[b]-as-indacene-based chromophores with a push–pull assembly: a DFT approach (2024)

    Khalid, Muhammad ; Murtaza, Shahzad; Gull, Khansa; Abid, Saba; Imran, Muhammad ; Braga, Ataualpa Albert Carmo

    Source: RSC Advances. Unidade: IQ

    Subjects: ÓPTICA NÃO LINEAR, FIBRA ÓPTICA

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      KHALID, Muhammad et al. Influence of acceptors on the optical nonlinearity of 5H-4-oxa-1,6,9-trithia-cyclopenta[b]-as-indacene-based chromophores with a push–pull assembly: a DFT approach. RSC Advances, v. 14, p. 1169–1185, 2024Tradução . . Disponível em: https://dx.doi.org/10.1039/d3ra06673h. Acesso em: 09 ago. 2024.

    • APA

      Khalid, M., Murtaza, S., Gull, K., Abid, S., Imran, M., & Braga, A. A. C. (2024). Influence of acceptors on the optical nonlinearity of 5H-4-oxa-1,6,9-trithia-cyclopenta[b]-as-indacene-based chromophores with a push–pull assembly: a DFT approach. RSC Advances, 14, 1169–1185. doi:10.1039/d3ra06673h

    • NLM

      Khalid M, Murtaza S, Gull K, Abid S, Imran M, Braga AAC. Influence of acceptors on the optical nonlinearity of 5H-4-oxa-1,6,9-trithia-cyclopenta[b]-as-indacene-based chromophores with a push–pull assembly: a DFT approach [Internet]. RSC Advances. 2024 ; 14 1169–1185.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1039/d3ra06673h

    • Vancouver

      Khalid M, Murtaza S, Gull K, Abid S, Imran M, Braga AAC. Influence of acceptors on the optical nonlinearity of 5H-4-oxa-1,6,9-trithia-cyclopenta[b]-as-indacene-based chromophores with a push–pull assembly: a DFT approach [Internet]. RSC Advances. 2024 ; 14 1169–1185.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1039/d3ra06673h

  • 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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      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: 09 ago. 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 ago. 09 ] 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 ago. 09 ] Available from: https://dx.doi.org/10.1021/acs.iecr.3c04133

  • Artigo de periodico

    Leader spirituality and organizational innovativeness as determinants of transformational leadership and project success: behavioral and social learning perspectives (2024)

    Raziq, Muhammad Mustafa; Saleem, Sharjeel; Borini, Felipe Mendes ; Naz, Farah

    Source: International Journal od Productivity and Performance Management. Unidade: FEA

    Subjects: LIDERANÇA, ESPIRITUALIDADE, INOVAÇÃO, SUCESSO NOS NEGÓCIOS

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      RAZIQ, Muhammad Mustafa et al. Leader spirituality and organizational innovativeness as determinants of transformational leadership and project success: behavioral and social learning perspectives. International Journal od Productivity and Performance Management, 2024Tradução . . Disponível em: https://doi.org/10.1108/IJPPM-05-2023-0211. Acesso em: 09 ago. 2024.

    • APA

      Raziq, M. M., Saleem, S., Borini, F. M., & Naz, F. (2024). Leader spirituality and organizational innovativeness as determinants of transformational leadership and project success: behavioral and social learning perspectives. International Journal od Productivity and Performance Management. doi:10.1108/IJPPM-05-2023-0211

    • NLM

      Raziq MM, Saleem S, Borini FM, Naz F. Leader spirituality and organizational innovativeness as determinants of transformational leadership and project success: behavioral and social learning perspectives [Internet]. International Journal od Productivity and Performance Management. 2024 ;[citado 2024 ago. 09 ] Available from: https://doi.org/10.1108/IJPPM-05-2023-0211

    • Vancouver

      Raziq MM, Saleem S, Borini FM, Naz F. Leader spirituality and organizational innovativeness as determinants of transformational leadership and project success: behavioral and social learning perspectives [Internet]. International Journal od Productivity and Performance Management. 2024 ;[citado 2024 ago. 09 ] Available from: https://doi.org/10.1108/IJPPM-05-2023-0211

  • Artigo de periodico

    An R-type hexagonal ferrite nanoparticles-based electrochemical sensor for Levofloxacin detection in pharmaceutical and clinical specimens (2024)

    Hussain, Sajjad ; Sadiq, Imran; Baig, Jameel Ahmed; Bertotti, Mauro ; Riaz, Saira

    Source: Microchemical Journal. Unidade: IQ

    Subjects: NANOPARTÍCULAS, ESPECTROSCOPIA

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      HUSSAIN, Sajjad et al. An R-type hexagonal ferrite nanoparticles-based electrochemical sensor for Levofloxacin detection in pharmaceutical and clinical specimens. Microchemical Journal, v. 201, p. 1-8 art. 110690, 2024Tradução . . Disponível em: https://dx.doi.org/10.1016/j.microc.2024.110690. Acesso em: 09 ago. 2024.

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      Hussain, S., Sadiq, I., Baig, J. A., Bertotti, M., & Riaz, S. (2024). An R-type hexagonal ferrite nanoparticles-based electrochemical sensor for Levofloxacin detection in pharmaceutical and clinical specimens. Microchemical Journal, 201, 1-8 art. 110690. doi:10.1016/j.microc.2024.110690

    • NLM

      Hussain S, Sadiq I, Baig JA, Bertotti M, Riaz S. An R-type hexagonal ferrite nanoparticles-based electrochemical sensor for Levofloxacin detection in pharmaceutical and clinical specimens [Internet]. Microchemical Journal. 2024 ; 201 1-8 art. 110690.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1016/j.microc.2024.110690

    • Vancouver

      Hussain S, Sadiq I, Baig JA, Bertotti M, Riaz S. An R-type hexagonal ferrite nanoparticles-based electrochemical sensor for Levofloxacin detection in pharmaceutical and clinical specimens [Internet]. Microchemical Journal. 2024 ; 201 1-8 art. 110690.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1016/j.microc.2024.110690

  • Artigo de periodico

    Impact of extended π-conjugated acceptor moieties on non-linear optical behavior in polar medium for designed 4,4-dimethyl-4H-indeno[1,2-b] thiophene based materials (2024)

    Khalid, Muhammad; Wu, Gang; Umber, Areeha; Khan, Mashal; Braga, Ataualpa Albert Carmo ; Alhokbany, Norah; Ojha, Suvash Chandra

    Source: Journal of Molecular Liquids. Unidade: IQ

    Subjects: COMPOSTOS ORGÂNICOS, MATERIAIS ÓPTICOS

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    • ABNT

      KHALID, Muhammad et al. Impact of extended π-conjugated acceptor moieties on non-linear optical behavior in polar medium for designed 4,4-dimethyl-4H-indeno[1,2-b] thiophene based materials. Journal of Molecular Liquids, v. 401, p. 1-13 art. 124608, 2024Tradução . . Disponível em: https://dx.doi.org/10.1016/j.molliq.2024.124608. Acesso em: 09 ago. 2024.

    • APA

      Khalid, M., Wu, G., Umber, A., Khan, M., Braga, A. A. C., Alhokbany, N., & Ojha, S. C. (2024). Impact of extended π-conjugated acceptor moieties on non-linear optical behavior in polar medium for designed 4,4-dimethyl-4H-indeno[1,2-b] thiophene based materials. Journal of Molecular Liquids, 401, 1-13 art. 124608. doi:10.1016/j.molliq.2024.124608

    • NLM

      Khalid M, Wu G, Umber A, Khan M, Braga AAC, Alhokbany N, Ojha SC. Impact of extended π-conjugated acceptor moieties on non-linear optical behavior in polar medium for designed 4,4-dimethyl-4H-indeno[1,2-b] thiophene based materials [Internet]. Journal of Molecular Liquids. 2024 ; 401 1-13 art. 124608.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1016/j.molliq.2024.124608

    • Vancouver

      Khalid M, Wu G, Umber A, Khan M, Braga AAC, Alhokbany N, Ojha SC. Impact of extended π-conjugated acceptor moieties on non-linear optical behavior in polar medium for designed 4,4-dimethyl-4H-indeno[1,2-b] thiophene based materials [Internet]. Journal of Molecular Liquids. 2024 ; 401 1-13 art. 124608.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1016/j.molliq.2024.124608

  • Artigo de periodico

    Improved the optical nonlinearity of carbazole based chromophores via molecular engineering: a DFT approach (2024)

    Khalid, Muhammad; Yasmeen, Sidra; Ahmed, Sarfraz ; Asghar, Muhammad Adnan; Imran, Muhammad; Braga, Ataualpa Albert Carmo ; Ojha, Suvash Chandra

    Source: Arabian Journal of Chemistry. Unidade: IQ

    Subjects: ENGENHARIA, MATERIAIS ÓPTICOS

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      KHALID, Muhammad et al. Improved the optical nonlinearity of carbazole based chromophores via molecular engineering: a DFT approach. Arabian Journal of Chemistry, v. 17, p. 1-11 art. 105753, 2024Tradução . . Disponível em: https://dx.doi.org/10.1016/j.arabjc.2024.105753. Acesso em: 09 ago. 2024.

    • APA

      Khalid, M., Yasmeen, S., Ahmed, S., Asghar, M. A., Imran, M., Braga, A. A. C., & Ojha, S. C. (2024). Improved the optical nonlinearity of carbazole based chromophores via molecular engineering: a DFT approach. Arabian Journal of Chemistry, 17, 1-11 art. 105753. doi:10.1016/j.arabjc.2024.105753

    • NLM

      Khalid M, Yasmeen S, Ahmed S, Asghar MA, Imran M, Braga AAC, Ojha SC. Improved the optical nonlinearity of carbazole based chromophores via molecular engineering: a DFT approach [Internet]. Arabian Journal of Chemistry. 2024 ; 17 1-11 art. 105753.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1016/j.arabjc.2024.105753

    • Vancouver

      Khalid M, Yasmeen S, Ahmed S, Asghar MA, Imran M, Braga AAC, Ojha SC. Improved the optical nonlinearity of carbazole based chromophores via molecular engineering: a DFT approach [Internet]. Arabian Journal of Chemistry. 2024 ; 17 1-11 art. 105753.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1016/j.arabjc.2024.105753

  • Artigo de periodico

    Effect of drying methods on the structure and properties of bacterial nanocellulose/MoS2 hybrid gel membranes and sphere-like particles for enhanced adsorption and photocatalytic applications (2024)

    Marchiori, Leonardo; Santos, Leonardo Souza; Schuler, Thiago; Bernardes, Joseane Caroline; Mattos, Bianca Oliveira ; Onishi, Bruno Seiki Domingos; Bortoletto-Santos, Ricardo; Rodrigues Filho, Ubirajara Pereira ; Domeneguetti, Rafael Romano; Ullah, Sajjad; Rambo, Carlos Renato Rambo; Ferreira Neto, Elias Paiva ; Ribeiro, Sidney José Lima

    Source: Journal of Sol-Gel Science and Technology. Unidades: IQSC, EESC

    Subjects: SECAGEM, FOTOCATÁLISE

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      MARCHIORI, Leonardo et al. Effect of drying methods on the structure and properties of bacterial nanocellulose/MoS2 hybrid gel membranes and sphere-like particles for enhanced adsorption and photocatalytic applications. Journal of Sol-Gel Science and Technology, p. online, 2024Tradução . . Disponível em: https://doi.org/10.1007/s10971-024-06380-2. Acesso em: 09 ago. 2024.

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      Marchiori, L., Santos, L. S., Schuler, T., Bernardes, J. C., Mattos, B. O., Onishi, B. S. D., et al. (2024). Effect of drying methods on the structure and properties of bacterial nanocellulose/MoS2 hybrid gel membranes and sphere-like particles for enhanced adsorption and photocatalytic applications. Journal of Sol-Gel Science and Technology, online. doi:10.1007/s10971-024-06380-2

    • NLM

      Marchiori L, Santos LS, Schuler T, Bernardes JC, Mattos BO, Onishi BSD, Bortoletto-Santos R, Rodrigues Filho UP, Domeneguetti RR, Ullah S, Rambo CRR, Ferreira Neto EP, Ribeiro SJL. Effect of drying methods on the structure and properties of bacterial nanocellulose/MoS2 hybrid gel membranes and sphere-like particles for enhanced adsorption and photocatalytic applications [Internet]. Journal of Sol-Gel Science and Technology. 2024 ;online.[citado 2024 ago. 09 ] Available from: https://doi.org/10.1007/s10971-024-06380-2

    • Vancouver

      Marchiori L, Santos LS, Schuler T, Bernardes JC, Mattos BO, Onishi BSD, Bortoletto-Santos R, Rodrigues Filho UP, Domeneguetti RR, Ullah S, Rambo CRR, Ferreira Neto EP, Ribeiro SJL. Effect of drying methods on the structure and properties of bacterial nanocellulose/MoS2 hybrid gel membranes and sphere-like particles for enhanced adsorption and photocatalytic applications [Internet]. Journal of Sol-Gel Science and Technology. 2024 ;online.[citado 2024 ago. 09 ] Available from: https://doi.org/10.1007/s10971-024-06380-2

  • Artigo de periodico

    Unveiling the influence of end-capped acceptors modification on photovoltaic properties of non-fullerene fused ring compounds: a DFT/TD-DFT study (2024)

    Khalid, Muhammad ; Fatima, Noor; Arshad, Muhammad; Adeel, Muhammad; Braga, Ataualpa Albert Carmo ; Ahamad, Tansir

    Source: RSC Advances. Unidade: IQ

    Subjects: CÉLULAS SOLARES, ORBITAL MOLECULAR

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    • ABNT

      KHALID, Muhammad et al. Unveiling the influence of end-capped acceptors modification on photovoltaic properties of non-fullerene fused ring compounds: a DFT/TD-DFT study. RSC Advances, v. 14, p. 20441–20453, 2024Tradução . . Disponível em: https://dx.doi.org/10.1039/d4ra03170a. Acesso em: 09 ago. 2024.

    • APA

      Khalid, M., Fatima, N., Arshad, M., Adeel, M., Braga, A. A. C., & Ahamad, T. (2024). Unveiling the influence of end-capped acceptors modification on photovoltaic properties of non-fullerene fused ring compounds: a DFT/TD-DFT study. RSC Advances, 14, 20441–20453. doi:10.1039/d4ra03170a

    • NLM

      Khalid M, Fatima N, Arshad M, Adeel M, Braga AAC, Ahamad T. Unveiling the influence of end-capped acceptors modification on photovoltaic properties of non-fullerene fused ring compounds: a DFT/TD-DFT study [Internet]. RSC Advances. 2024 ; 14 20441–20453.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1039/d4ra03170a

    • Vancouver

      Khalid M, Fatima N, Arshad M, Adeel M, Braga AAC, Ahamad T. Unveiling the influence of end-capped acceptors modification on photovoltaic properties of non-fullerene fused ring compounds: a DFT/TD-DFT study [Internet]. RSC Advances. 2024 ; 14 20441–20453.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1039/d4ra03170a

  • Artigo de periodico

    Facile synthesis, spectroscopic and nonlinear optical insights of Hydrazinyl-based functional materials: experimental and DFT approach (2024)

    Mehmood, Hasnain; Akhtar, Tashfeen ; Haroon, Muhammad; khalid, Muhammad; Woodward, Simon; Shafiq, Iqra ; Braga, Ataualpa Albert Carmo ; Alhokbany, Norah

    Source: Polycyclic Aromatic Compounds. Unidade: IQ

    Subjects: QUÍMICA QUÂNTICA, ESPECTROSCOPIA

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      MEHMOOD, Hasnain et al. Facile synthesis, spectroscopic and nonlinear optical insights of Hydrazinyl-based functional materials: experimental and DFT approach. Polycyclic Aromatic Compounds, v. 44, n. 5, p. 3456–3475, 2024Tradução . . Disponível em: https://dx.doi.org/10.1080/10406638.2023.2235871. Acesso em: 09 ago. 2024.

    • APA

      Mehmood, H., Akhtar, T., Haroon, M., khalid, M., Woodward, S., Shafiq, I., et al. (2024). Facile synthesis, spectroscopic and nonlinear optical insights of Hydrazinyl-based functional materials: experimental and DFT approach. Polycyclic Aromatic Compounds, 44( 5), 3456–3475. doi:10.1080/10406638.2023.2235871

    • NLM

      Mehmood H, Akhtar T, Haroon M, khalid M, Woodward S, Shafiq I, Braga AAC, Alhokbany N. Facile synthesis, spectroscopic and nonlinear optical insights of Hydrazinyl-based functional materials: experimental and DFT approach [Internet]. Polycyclic Aromatic Compounds. 2024 ; 44( 5): 3456–3475.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1080/10406638.2023.2235871

    • Vancouver

      Mehmood H, Akhtar T, Haroon M, khalid M, Woodward S, Shafiq I, Braga AAC, Alhokbany N. Facile synthesis, spectroscopic and nonlinear optical insights of Hydrazinyl-based functional materials: experimental and DFT approach [Internet]. Polycyclic Aromatic Compounds. 2024 ; 44( 5): 3456–3475.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1080/10406638.2023.2235871

  • Artigo de periodico

    A matrix solver approach for fracture flow simulation by Analytic Element Method (2024)

    Hussain, Sardar Muhammad; Cuminato, José Alberto ; Marin, Ivan Silvestre Paganini; Wendland, Edson Cezar

    Source: Mathematics and Computers in Simulation. Unidades: EESC, ICMC

    Subjects: ÁGUAS SUBTERRÂNEAS, CONDUTIVIDADE HIDRÁULICA DO SOLO, ENGENHARIA HIDRÁULICA

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      HUSSAIN, Sardar Muhammad et al. A matrix solver approach for fracture flow simulation by Analytic Element Method. Mathematics and Computers in Simulation, v. 218, p. 666-678, 2024Tradução . . Disponível em: https://dx.doi.org/10.1016/j.matcom.2023.12.014. Acesso em: 09 ago. 2024.

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      Hussain, S. M., Cuminato, J. A., Marin, I. S. P., & Wendland, E. C. (2024). A matrix solver approach for fracture flow simulation by Analytic Element Method. Mathematics and Computers in Simulation, 218, 666-678. doi:10.1016/j.matcom.2023.12.014

    • NLM

      Hussain SM, Cuminato JA, Marin ISP, Wendland EC. A matrix solver approach for fracture flow simulation by Analytic Element Method [Internet]. Mathematics and Computers in Simulation. 2024 ; 218 666-678.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1016/j.matcom.2023.12.014

    • Vancouver

      Hussain SM, Cuminato JA, Marin ISP, Wendland EC. A matrix solver approach for fracture flow simulation by Analytic Element Method [Internet]. Mathematics and Computers in Simulation. 2024 ; 218 666-678.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1016/j.matcom.2023.12.014

  • Artigo de periodico

    Integrated AI-driven optimization of Fenton process for the treatment of antibiotic sulfamethoxazole: Insights into mechanistic approach (2024)

    Gul, Saima; Hussain, Sajjad ; Khan, Hammad ; Arshad, Muhammad; Khan, Javaid Rabbani ; Motheo, Artur de Jesus

    Source: Chemosphere. Unidade: IQSC

    Subjects: INTELIGÊNCIA ARTIFICIAL, REDES NEURAIS, ANTIBIÓTICOS

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      GUL, Saima et al. Integrated AI-driven optimization of Fenton process for the treatment of antibiotic sulfamethoxazole: Insights into mechanistic approach. Chemosphere, v. 357, p. 141868, 2024Tradução . . Disponível em: https://doi.org/10.1016/j.chemosphere.2024.141868. Acesso em: 09 ago. 2024.

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      Gul, S., Hussain, S., Khan, H., Arshad, M., Khan, J. R., & Motheo, A. de J. (2024). Integrated AI-driven optimization of Fenton process for the treatment of antibiotic sulfamethoxazole: Insights into mechanistic approach. Chemosphere, 357, 141868. doi:10.1016/j.chemosphere.2024.141868

    • NLM

      Gul S, Hussain S, Khan H, Arshad M, Khan JR, Motheo A de J. Integrated AI-driven optimization of Fenton process for the treatment of antibiotic sulfamethoxazole: Insights into mechanistic approach [Internet]. Chemosphere. 2024 ; 357 141868.[citado 2024 ago. 09 ] Available from: https://doi.org/10.1016/j.chemosphere.2024.141868

    • Vancouver

      Gul S, Hussain S, Khan H, Arshad M, Khan JR, Motheo A de J. Integrated AI-driven optimization of Fenton process for the treatment of antibiotic sulfamethoxazole: Insights into mechanistic approach [Internet]. Chemosphere. 2024 ; 357 141868.[citado 2024 ago. 09 ] Available from: https://doi.org/10.1016/j.chemosphere.2024.141868

  • Artigo de periodico

    Theoretical approach towards benzodithiophene-based chromophores with extended acceptors for prediction of efficient nonlinear optical behaviour (2024)

    Khalid, Muhammad ; Maqsood, Rabia; Shafiq, Iqra ; Baby, Rabia ; Asghar, Muhammad Adnan ; Ahmed, Sarfraz ; Alshehri, Saad M ; Braga, Ataualpa Albert Carmo

    Source: Arabian Journal for Science and Engineering. Unidade: IQ

    Assunto: QUÍMICA QUÂNTICA

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      KHALID, Muhammad et al. Theoretical approach towards benzodithiophene-based chromophores with extended acceptors for prediction of efficient nonlinear optical behaviour. Arabian Journal for Science and Engineering, v. 49, p. 339–359, 2024Tradução . . Disponível em: https://doi.org/10.1007/s13369-023-08136-6. Acesso em: 09 ago. 2024.

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      Khalid, M., Maqsood, R., Shafiq, I., Baby, R., Asghar, M. A., Ahmed, S., et al. (2024). Theoretical approach towards benzodithiophene-based chromophores with extended acceptors for prediction of efficient nonlinear optical behaviour. Arabian Journal for Science and Engineering, 49, 339–359. doi:10.1007/s13369-023-08136-6

    • NLM

      Khalid M, Maqsood R, Shafiq I, Baby R, Asghar MA, Ahmed S, Alshehri SM, Braga AAC. Theoretical approach towards benzodithiophene-based chromophores with extended acceptors for prediction of efficient nonlinear optical behaviour [Internet]. Arabian Journal for Science and Engineering. 2024 ; 49 339–359.[citado 2024 ago. 09 ] Available from: https://doi.org/10.1007/s13369-023-08136-6

    • Vancouver

      Khalid M, Maqsood R, Shafiq I, Baby R, Asghar MA, Ahmed S, Alshehri SM, Braga AAC. Theoretical approach towards benzodithiophene-based chromophores with extended acceptors for prediction of efficient nonlinear optical behaviour [Internet]. Arabian Journal for Science and Engineering. 2024 ; 49 339–359.[citado 2024 ago. 09 ] Available from: https://doi.org/10.1007/s13369-023-08136-6

  • Artigo de periodico

    Exploration of photovoltaic properties towards efficient organic solar cells for Thieno[3,2-b]thiophene fused naphthalene core based acceptor derivatives (2024)

    Khalid, Muhammad; Mustafa, Ayesha; Braga, Ataualpa Albert Carmo; Asghar, Muhammad Adnan; Raza, Nadeem; Khairy, Mohamed

    Source: Journal of Photochemistry & Photobiology A. Unidade: IQ

    Subjects: CÉLULAS SOLARES, ÓPTICA ELETRÔNICA

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      KHALID, Muhammad et al. Exploration of photovoltaic properties towards efficient organic solar cells for Thieno[3,2-b]thiophene fused naphthalene core based acceptor derivatives. Journal of Photochemistry & Photobiology A, v. 447, p. 1-14 art. 115279, 2024Tradução . . Disponível em: https://dx.doi.org/10.1016/j.jphotochem.2023.115279. Acesso em: 09 ago. 2024.

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      Khalid, M., Mustafa, A., Braga, A. A. C., Asghar, M. A., Raza, N., & Khairy, M. (2024). Exploration of photovoltaic properties towards efficient organic solar cells for Thieno[3,2-b]thiophene fused naphthalene core based acceptor derivatives. Journal of Photochemistry & Photobiology A, 447, 1-14 art. 115279. doi:10.1016/j.jphotochem.2023.115279

    • NLM

      Khalid M, Mustafa A, Braga AAC, Asghar MA, Raza N, Khairy M. Exploration of photovoltaic properties towards efficient organic solar cells for Thieno[3,2-b]thiophene fused naphthalene core based acceptor derivatives [Internet]. Journal of Photochemistry & Photobiology A. 2024 ; 447 1-14 art. 115279.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1016/j.jphotochem.2023.115279

    • Vancouver

      Khalid M, Mustafa A, Braga AAC, Asghar MA, Raza N, Khairy M. Exploration of photovoltaic properties towards efficient organic solar cells for Thieno[3,2-b]thiophene fused naphthalene core based acceptor derivatives [Internet]. Journal of Photochemistry & Photobiology A. 2024 ; 447 1-14 art. 115279.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1016/j.jphotochem.2023.115279

  • Artigo de periodico

    Use of benzothiophene ring to improve the photovoltaic efficacy of cyanopyridinone-based organic chromophores: a DFT study (2024)

    Shafiq, Iqra; Khalid, Muhammad ; Maria, Gul; Raza, Nadeem; Braga, Ataualpa Albert Carmo ; Bullo, Saifullah ; Khairy, Mohamed

    Source: RSC Advances. Unidade: IQ

    Subjects: CRISE ENERGÉTICA, ENERGIA EÓLICA

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      SHAFIQ, Iqra et al. Use of benzothiophene ring to improve the photovoltaic efficacy of cyanopyridinone-based organic chromophores: a DFT study. RSC Advances, v. 14, p. 12841-12852, 2024Tradução . . Disponível em: https://dx.doi.org/10.1039/d3ra06817j. Acesso em: 09 ago. 2024.

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      Shafiq, I., Khalid, M., Maria, G., Raza, N., Braga, A. A. C., Bullo, S., & Khairy, M. (2024). Use of benzothiophene ring to improve the photovoltaic efficacy of cyanopyridinone-based organic chromophores: a DFT study. RSC Advances, 14, 12841-12852. doi:10.1039/d3ra06817j

    • NLM

      Shafiq I, Khalid M, Maria G, Raza N, Braga AAC, Bullo S, Khairy M. Use of benzothiophene ring to improve the photovoltaic efficacy of cyanopyridinone-based organic chromophores: a DFT study [Internet]. RSC Advances. 2024 ; 14 12841-12852.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1039/d3ra06817j

    • Vancouver

      Shafiq I, Khalid M, Maria G, Raza N, Braga AAC, Bullo S, Khairy M. Use of benzothiophene ring to improve the photovoltaic efficacy of cyanopyridinone-based organic chromophores: a DFT study [Internet]. RSC Advances. 2024 ; 14 12841-12852.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1039/d3ra06817j

  • Artigo de periodico

    SC-XRD structural characterization, insights of key electronic, and nonlinear optical properties of dimethoxybenzenesulfonate crystals: a combine experimental and DFT approach (2024)

    Arshad, Muhammad Nadeem ; khalid, Muhammad; Sheikh, Tahir Ali ; Asad, Mohammad ; Alzahrani, Khalid A; Marwani, Hadi M; Braga, Ataualpa Albert Carmo

    Source: Journal of Molecular Structure. Unidade: IQ

    Subjects: ÓPTICA NÃO LINEAR, CLORETO, BENZENO

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      ARSHAD, Muhammad Nadeem et al. SC-XRD structural characterization, insights of key electronic, and nonlinear optical properties of dimethoxybenzenesulfonate crystals: a combine experimental and DFT approach. Journal of Molecular Structure, v. 1314, p. 1-17 art. 138696, 2024Tradução . . Disponível em: https://dx.doi.org/10.1016/j.molstruc.2024.138696. Acesso em: 09 ago. 2024.

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      Arshad, M. N., khalid, M., Sheikh, T. A., Asad, M., Alzahrani, K. A., Marwani, H. M., & Braga, A. A. C. (2024). SC-XRD structural characterization, insights of key electronic, and nonlinear optical properties of dimethoxybenzenesulfonate crystals: a combine experimental and DFT approach. Journal of Molecular Structure, 1314, 1-17 art. 138696. doi:10.1016/j.molstruc.2024.138696

    • NLM

      Arshad MN, khalid M, Sheikh TA, Asad M, Alzahrani KA, Marwani HM, Braga AAC. SC-XRD structural characterization, insights of key electronic, and nonlinear optical properties of dimethoxybenzenesulfonate crystals: a combine experimental and DFT approach [Internet]. Journal of Molecular Structure. 2024 ; 1314 1-17 art. 138696.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1016/j.molstruc.2024.138696

    • Vancouver

      Arshad MN, khalid M, Sheikh TA, Asad M, Alzahrani KA, Marwani HM, Braga AAC. SC-XRD structural characterization, insights of key electronic, and nonlinear optical properties of dimethoxybenzenesulfonate crystals: a combine experimental and DFT approach [Internet]. Journal of Molecular Structure. 2024 ; 1314 1-17 art. 138696.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1016/j.molstruc.2024.138696

  • Artigo de periodico

    Nutraceutical formulated oil-in-water emulsion: Synthesis, characterization and biological applications (2024)

    Khan, Kamran; Shah, Ziarat; Hussain, Saddam; Hassan, Waseem; Khan, Zala; Pawlicka, Agnieszka

    Source: Journal of Molecular Liquids. Unidade: IQSC

    Subjects: EXAME FÍSICO, EMULSÕES (FORMAS FARMACÊUTICAS)

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      KHAN, Kamran et al. Nutraceutical formulated oil-in-water emulsion: Synthesis, characterization and biological applications. Journal of Molecular Liquids, v. 408, p. 125387, 2024Tradução . . Disponível em: https://doi.org/10.1016/j.molliq.2024.125387. Acesso em: 09 ago. 2024.

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      Khan, K., Shah, Z., Hussain, S., Hassan, W., Khan, Z., & Pawlicka, A. (2024). Nutraceutical formulated oil-in-water emulsion: Synthesis, characterization and biological applications. Journal of Molecular Liquids, 408, 125387. doi:10.1016/j.molliq.2024.125387

    • NLM

      Khan K, Shah Z, Hussain S, Hassan W, Khan Z, Pawlicka A. Nutraceutical formulated oil-in-water emulsion: Synthesis, characterization and biological applications [Internet]. Journal of Molecular Liquids. 2024 ;408 125387.[citado 2024 ago. 09 ] Available from: https://doi.org/10.1016/j.molliq.2024.125387

    • Vancouver

      Khan K, Shah Z, Hussain S, Hassan W, Khan Z, Pawlicka A. Nutraceutical formulated oil-in-water emulsion: Synthesis, characterization and biological applications [Internet]. Journal of Molecular Liquids. 2024 ;408 125387.[citado 2024 ago. 09 ] Available from: https://doi.org/10.1016/j.molliq.2024.125387

  • Artigo de periodico

    V-shaped naphthalene diimide-based chromophores: First theoretical framework for designing high efficacy of organic solar cells (2024)

    Khalid, Muhammad; Shafiq, Iqra ; Imran, Muhammad ; Jawaria, Rifat; Braga, Ataualpa Albert Carmo

    Source: Synthetic Metals. Unidade: IQ

    Subjects: CÉLULAS SOLARES, ELÉTRONS

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      KHALID, Muhammad et al. V-shaped naphthalene diimide-based chromophores: First theoretical framework for designing high efficacy of organic solar cells. Synthetic Metals, v. 303, p. 1-10 art. 117548, 2024Tradução . . Disponível em: https://dx.doi.org/10.1016/j.synthmet.2024.117548. Acesso em: 09 ago. 2024.

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      Khalid, M., Shafiq, I., Imran, M., Jawaria, R., & Braga, A. A. C. (2024). V-shaped naphthalene diimide-based chromophores: First theoretical framework for designing high efficacy of organic solar cells. Synthetic Metals, 303, 1-10 art. 117548. doi:10.1016/j.synthmet.2024.117548

    • NLM

      Khalid M, Shafiq I, Imran M, Jawaria R, Braga AAC. V-shaped naphthalene diimide-based chromophores: First theoretical framework for designing high efficacy of organic solar cells [Internet]. Synthetic Metals. 2024 ; 303 1-10 art. 117548.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1016/j.synthmet.2024.117548

    • Vancouver

      Khalid M, Shafiq I, Imran M, Jawaria R, Braga AAC. V-shaped naphthalene diimide-based chromophores: First theoretical framework for designing high efficacy of organic solar cells [Internet]. Synthetic Metals. 2024 ; 303 1-10 art. 117548.[citado 2024 ago. 09 ] Available from: https://dx.doi.org/10.1016/j.synthmet.2024.117548

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