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  • Artigo de periodico

    Exploration of selenophene analogue and different acceptor influence on photovoltaic properties of pyrrole-4,6(5-H)-dione based chromophores via quantum chemical investigations (2025)

    Khalid, Muhammad; Tayyab, Fatima; Adeel, Muhammad; Tahir, Nayab; Braga, Ataualpa Albert Carmo ; Alrashidi, Khalid Abdullah

    Source: scientific reports. Unidade: IQ

    Subjects: ENGENHARIA, FULERENO, COMPOSTOS ORGÂNICOS, ORBITAL MOLECULAR

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    • ABNT

      KHALID, Muhammad et al. Exploration of selenophene analogue and different acceptor influence on photovoltaic properties of pyrrole-4,6(5-H)-dione based chromophores via quantum chemical investigations. scientific reports, v. 15, p. 1-18 art. 14792, 2025Tradução . . Disponível em: https://dx.doi.org/10.1038/s41598-025-99585-6. Acesso em: 12 nov. 2025.

    • APA

      Khalid, M., Tayyab, F., Adeel, M., Tahir, N., Braga, A. A. C., & Alrashidi, K. A. (2025). Exploration of selenophene analogue and different acceptor influence on photovoltaic properties of pyrrole-4,6(5-H)-dione based chromophores via quantum chemical investigations. scientific reports, 15, 1-18 art. 14792. doi:10.1038/s41598-025-99585-6

    • NLM

      Khalid M, Tayyab F, Adeel M, Tahir N, Braga AAC, Alrashidi KA. Exploration of selenophene analogue and different acceptor influence on photovoltaic properties of pyrrole-4,6(5-H)-dione based chromophores via quantum chemical investigations [Internet]. scientific reports. 2025 ; 15 1-18 art. 14792.[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.1038/s41598-025-99585-6

    • Vancouver

      Khalid M, Tayyab F, Adeel M, Tahir N, Braga AAC, Alrashidi KA. Exploration of selenophene analogue and different acceptor influence on photovoltaic properties of pyrrole-4,6(5-H)-dione based chromophores via quantum chemical investigations [Internet]. scientific reports. 2025 ; 15 1-18 art. 14792.[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.1038/s41598-025-99585-6

  • Artigo de periodico

    Gd3+ and Sm3+ ions modulated visible-light-emitting ZnSe:Mn2+ nanocrystals for detection of Pb2+ and Hg2+ (2025)

    Gul, Iram; Khan, Zahid Ullah ; Galani, Sammra; Huda, Subul ; Khan, Latif Ullah ; Juwhari, Hassan K ; Hyder, Ali; Brito, Hermi Felinto de ; Zaheer, Muhammad ; Khan, Muhammad Abdullah

    Source: ACS Applied Optical Materials. Unidades: IQ, EP

    Subjects: ÍONS, METAIS PESADOS

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    • ABNT

      GUL, Iram et al. Gd3+ and Sm3+ ions modulated visible-light-emitting ZnSe:Mn2+ nanocrystals for detection of Pb2+ and Hg2+. ACS Applied Optical Materials, v. 3, n. 9, p. 2067–2077, 2025Tradução . . Disponível em: https://dx.doi.org/10.1021/acsaom.5c00240. Acesso em: 12 nov. 2025.

    • APA

      Gul, I., Khan, Z. U., Galani, S., Huda, S., Khan, L. U., Juwhari, H. K., et al. (2025). Gd3+ and Sm3+ ions modulated visible-light-emitting ZnSe:Mn2+ nanocrystals for detection of Pb2+ and Hg2+. ACS Applied Optical Materials, 3( 9), 2067–2077. doi:10.1021/acsaom.5c00240

    • NLM

      Gul I, Khan ZU, Galani S, Huda S, Khan LU, Juwhari HK, Hyder A, Brito HF de, Zaheer M, Khan MA. Gd3+ and Sm3+ ions modulated visible-light-emitting ZnSe:Mn2+ nanocrystals for detection of Pb2+ and Hg2+ [Internet]. ACS Applied Optical Materials. 2025 ; 3( 9): 2067–2077.[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.1021/acsaom.5c00240

    • Vancouver

      Gul I, Khan ZU, Galani S, Huda S, Khan LU, Juwhari HK, Hyder A, Brito HF de, Zaheer M, Khan MA. Gd3+ and Sm3+ ions modulated visible-light-emitting ZnSe:Mn2+ nanocrystals for detection of Pb2+ and Hg2+ [Internet]. ACS Applied Optical Materials. 2025 ; 3( 9): 2067–2077.[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.1021/acsaom.5c00240

  • Artigo de periodico

    Exploration of optoelectronic and photovoltaic properties for azaborinine-based materials via symmetrically coupled acceptors: a DFT/TD-DFT approach (2025)

    Khalid, Muhammad; Murtaza, Shahzad ; Mussarat, Ayesha; Ahamad, Tansir ; Braga, Ataualpa Albert Carmo ; Ojha, Suvash Chandra

    Source: Arabian Journal of Chemistry. Unidade: IQ

    Subjects: CÉLULAS SOLARES, FULERENO

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    • ABNT

      KHALID, Muhammad et al. Exploration of optoelectronic and photovoltaic properties for azaborinine-based materials via symmetrically coupled acceptors: a DFT/TD-DFT approach. Arabian Journal of Chemistry, 2025Tradução . . Disponível em: https://dx.doi.org/10.25259/AJC_61_2025. Acesso em: 12 nov. 2025.

    • APA

      Khalid, M., Murtaza, S., Mussarat, A., Ahamad, T., Braga, A. A. C., & Ojha, S. C. (2025). Exploration of optoelectronic and photovoltaic properties for azaborinine-based materials via symmetrically coupled acceptors: a DFT/TD-DFT approach. Arabian Journal of Chemistry. doi:10.25259/AJC_61_2025

    • NLM

      Khalid M, Murtaza S, Mussarat A, Ahamad T, Braga AAC, Ojha SC. Exploration of optoelectronic and photovoltaic properties for azaborinine-based materials via symmetrically coupled acceptors: a DFT/TD-DFT approach [Internet]. Arabian Journal of Chemistry. 2025 ;[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.25259/AJC_61_2025

    • Vancouver

      Khalid M, Murtaza S, Mussarat A, Ahamad T, Braga AAC, Ojha SC. Exploration of optoelectronic and photovoltaic properties for azaborinine-based materials via symmetrically coupled acceptors: a DFT/TD-DFT approach [Internet]. Arabian Journal of Chemistry. 2025 ;[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.25259/AJC_61_2025

  • Artigo de periodico

    Unravelling the photovoltaic response of butterfly-shaped fulvene based chromophores with the influence of double acceptor moieties: a DFT approach (2025)

    Khalid, Muhammad; Kousar, Shehla; Haq, Saadia; Braga, Ataualpa Albert Carmo ; Akram, Muhammad Yasir; Alotaibi, Rajeh

    Source: Journal of Industrial and Engineering Chemistry. Unidade: IQ

    Subjects: MOLÉCULA, ÓPTICA ELETRÔNICA

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    • ABNT

      KHALID, Muhammad et al. Unravelling the photovoltaic response of butterfly-shaped fulvene based chromophores with the influence of double acceptor moieties: a DFT approach. Journal of Industrial and Engineering Chemistry, v. 142, p. 533-544, 2025Tradução . . Disponível em: https://dx.doi.org/10.1016/j.jiec.2024.07.059. Acesso em: 12 nov. 2025.

    • APA

      Khalid, M., Kousar, S., Haq, S., Braga, A. A. C., Akram, M. Y., & Alotaibi, R. (2025). Unravelling the photovoltaic response of butterfly-shaped fulvene based chromophores with the influence of double acceptor moieties: a DFT approach. Journal of Industrial and Engineering Chemistry, 142, 533-544. doi:10.1016/j.jiec.2024.07.059

    • NLM

      Khalid M, Kousar S, Haq S, Braga AAC, Akram MY, Alotaibi R. Unravelling the photovoltaic response of butterfly-shaped fulvene based chromophores with the influence of double acceptor moieties: a DFT approach [Internet]. Journal of Industrial and Engineering Chemistry. 2025 ; 142 533-544.[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.1016/j.jiec.2024.07.059

    • Vancouver

      Khalid M, Kousar S, Haq S, Braga AAC, Akram MY, Alotaibi R. Unravelling the photovoltaic response of butterfly-shaped fulvene based chromophores with the influence of double acceptor moieties: a DFT approach [Internet]. Journal of Industrial and Engineering Chemistry. 2025 ; 142 533-544.[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.1016/j.jiec.2024.07.059

  • Artigo de periodico

    Exploring key electronic and non-linear optical amplitute with bilateral intramolecular charge transfer into thieno[3,2-b]thiophene-based compounds: a DFT approach (2025)

    Khalid, Muhammad ; Arshad, Memoona; Haroon, Muhammad; Braga, Ataualpa Albert Carmo ; Alhokbany, Norah

    Source: RSC Advances. Unidade: IQ

    Subjects: MOLÉCULA, LIGANTES

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    • ABNT

      KHALID, Muhammad et al. Exploring key electronic and non-linear optical amplitute with bilateral intramolecular charge transfer into thieno[3,2-b]thiophene-based compounds: a DFT approach. RSC Advances, v. 15, p. 6291–6307, 2025Tradução . . Disponível em: https://dx.doi.org/10.1039/d4ra08662g. Acesso em: 12 nov. 2025.

    • APA

      Khalid, M., Arshad, M., Haroon, M., Braga, A. A. C., & Alhokbany, N. (2025). Exploring key electronic and non-linear optical amplitute with bilateral intramolecular charge transfer into thieno[3,2-b]thiophene-based compounds: a DFT approach. RSC Advances, 15, 6291–6307. doi:10.1039/d4ra08662g

    • NLM

      Khalid M, Arshad M, Haroon M, Braga AAC, Alhokbany N. Exploring key electronic and non-linear optical amplitute with bilateral intramolecular charge transfer into thieno[3,2-b]thiophene-based compounds: a DFT approach [Internet]. RSC Advances. 2025 ; 15 6291–6307.[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.1039/d4ra08662g

    • Vancouver

      Khalid M, Arshad M, Haroon M, Braga AAC, Alhokbany N. Exploring key electronic and non-linear optical amplitute with bilateral intramolecular charge transfer into thieno[3,2-b]thiophene-based compounds: a DFT approach [Internet]. RSC Advances. 2025 ; 15 6291–6307.[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.1039/d4ra08662g

  • Artigo de periodico

    Design and evaluation of indacenothienothiophene based functional materials for second and third order nonlinear optics properties via DFT approach (2025)

    Haq, Saadia; Khalid, Muhammad; Braga, Ataualpa Albert Carmo ; Alhokbany, Norah ; Chen, Ke

    Source: Scientific Reports. Unidade: IQ

    Subjects: ÓPTICA NÃO LINEAR, DENSIDADE, FOTÔNICA

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    • ABNT

      HAQ, Saadia et al. Design and evaluation of indacenothienothiophene based functional materials for second and third order nonlinear optics properties via DFT approach. Scientific Reports, v. 15, p. 1-18 art. 13262, 2025Tradução . . Disponível em: https://dx.doi.org/10.1038/s41598-025-96902-x. Acesso em: 12 nov. 2025.

    • APA

      Haq, S., Khalid, M., Braga, A. A. C., Alhokbany, N., & Chen, K. (2025). Design and evaluation of indacenothienothiophene based functional materials for second and third order nonlinear optics properties via DFT approach. Scientific Reports, 15, 1-18 art. 13262. doi:10.1038/s41598-025-96902-x

    • NLM

      Haq S, Khalid M, Braga AAC, Alhokbany N, Chen K. Design and evaluation of indacenothienothiophene based functional materials for second and third order nonlinear optics properties via DFT approach [Internet]. Scientific Reports. 2025 ; 15 1-18 art. 13262.[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.1038/s41598-025-96902-x

    • Vancouver

      Haq S, Khalid M, Braga AAC, Alhokbany N, Chen K. Design and evaluation of indacenothienothiophene based functional materials for second and third order nonlinear optics properties via DFT approach [Internet]. Scientific Reports. 2025 ; 15 1-18 art. 13262.[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.1038/s41598-025-96902-x

  • Artigo de periodico

    Maximizing profits while reducing environmental impacts in silvopastoral systems for Nellore: an idealized, simplified farm-level mathematical model (2025)

    Lobo, Annelise A. G ; Akhtar, Hafiz Muhammad Bilal ; Moreno, Deilen P. S ; Cortés, Carlos Francisco Alvarez ; Cumbe, Telis Adolfo Cumbe ; Péra,Thiago Guilherme ; Gameiro, Augusto Hauber

    Source: Brazilian Journal of Biology. Unidades: FMVZ, ESALQ

    Subjects: GADO NELORE, IMPACTOS AMBIENTAIS, MODELOS MATEMÁTICOS, SUSTENTABILIDADE, PROGRAMAÇÃO LINEAR, PESQUISA OPERACIONAL, SISTEMAS SILVIPASTORIS

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    • ABNT

      LOBO, Annelise A. G et al. Maximizing profits while reducing environmental impacts in silvopastoral systems for Nellore: an idealized, simplified farm-level mathematical model. Brazilian Journal of Biology, v. 85, p. 1-17, 2025Tradução . . Disponível em: https://doi.org/10.1590/1519-6984.288557. Acesso em: 12 nov. 2025.

    • APA

      Lobo, A. A. G., Akhtar, H. M. B., Moreno, D. P. S., Cortés, C. F. A., Cumbe, T. A. C., Péra, T. G., & Gameiro, A. H. (2025). Maximizing profits while reducing environmental impacts in silvopastoral systems for Nellore: an idealized, simplified farm-level mathematical model. Brazilian Journal of Biology, 85, 1-17. doi:10.1590/1519-6984.288557

    • NLM

      Lobo AAG, Akhtar HMB, Moreno DPS, Cortés CFA, Cumbe TAC, Péra TG, Gameiro AH. Maximizing profits while reducing environmental impacts in silvopastoral systems for Nellore: an idealized, simplified farm-level mathematical model [Internet]. Brazilian Journal of Biology. 2025 ; 85 1-17.[citado 2025 nov. 12 ] Available from: https://doi.org/10.1590/1519-6984.288557

    • Vancouver

      Lobo AAG, Akhtar HMB, Moreno DPS, Cortés CFA, Cumbe TAC, Péra TG, Gameiro AH. Maximizing profits while reducing environmental impacts in silvopastoral systems for Nellore: an idealized, simplified farm-level mathematical model [Internet]. Brazilian Journal of Biology. 2025 ; 85 1-17.[citado 2025 nov. 12 ] Available from: https://doi.org/10.1590/1519-6984.288557

  • Artigo de periodico

    Enhancing the photovoltaic properties of phenylsulfonyl carbazole-based materials by incorporating a thiophene ring and end-capped acceptors for organic solar cells: a DFT approach (2025)

    Khalid, Muhammad ; Amir, Laiba; Arshad, Muhammad; Shafiq, Iqra ; Braga, Ataualpa Albert Carmo ; Alrashidi, Khalid Abdullah

    Source: RSC Advances. Unidade: IQ

    Subjects: ENERGIA SOLAR, QUÍMICA QUÂNTICA, CÉLULAS SOLARES

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    • ABNT

      KHALID, Muhammad et al. Enhancing the photovoltaic properties of phenylsulfonyl carbazole-based materials by incorporating a thiophene ring and end-capped acceptors for organic solar cells: a DFT approach. RSC Advances, v. 15, p. 5965–5976, 2025Tradução . . Disponível em: https://dx.doi.org/10.1039/D4RA06073C. Acesso em: 12 nov. 2025.

    • APA

      Khalid, M., Amir, L., Arshad, M., Shafiq, I., Braga, A. A. C., & Alrashidi, K. A. (2025). Enhancing the photovoltaic properties of phenylsulfonyl carbazole-based materials by incorporating a thiophene ring and end-capped acceptors for organic solar cells: a DFT approach. RSC Advances, 15, 5965–5976. doi:10.1039/D4RA06073C

    • NLM

      Khalid M, Amir L, Arshad M, Shafiq I, Braga AAC, Alrashidi KA. Enhancing the photovoltaic properties of phenylsulfonyl carbazole-based materials by incorporating a thiophene ring and end-capped acceptors for organic solar cells: a DFT approach [Internet]. RSC Advances. 2025 ; 15 5965–5976.[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.1039/D4RA06073C

    • Vancouver

      Khalid M, Amir L, Arshad M, Shafiq I, Braga AAC, Alrashidi KA. Enhancing the photovoltaic properties of phenylsulfonyl carbazole-based materials by incorporating a thiophene ring and end-capped acceptors for organic solar cells: a DFT approach [Internet]. RSC Advances. 2025 ; 15 5965–5976.[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.1039/D4RA06073C

  • Artigo de periodico

    Ln3+-ion-mediated enhancement in UV/X-ray-induced optical emission from Mn2+-doped ZnSe nanocrystals (2025)

    Gul, Iram; Khan, Zahid Ullah ; Khan, Muhammad Abdullah ; Pasca, Gabriel A. Cabrera; AlZubi, Ruba I ; Figueroa, Santiago J A ; Brito, Hermi Felinto de ; Khan, Latif Ullah

    Source: Nanoscale. Unidades: IQ, EP

    Subjects: LUMINESCÊNCIA, ESPECTROSCOPIA

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    • ABNT

      GUL, Iram et al. Ln3+-ion-mediated enhancement in UV/X-ray-induced optical emission from Mn2+-doped ZnSe nanocrystals. Nanoscale, v. 17, n. 25, p. 15393-15401, 2025Tradução . . Disponível em: https://dx.doi.org/10.1039/d5nr01263e. Acesso em: 12 nov. 2025.

    • APA

      Gul, I., Khan, Z. U., Khan, M. A., Pasca, G. A. C., AlZubi, R. I., Figueroa, S. J. A., et al. (2025). Ln3+-ion-mediated enhancement in UV/X-ray-induced optical emission from Mn2+-doped ZnSe nanocrystals. Nanoscale, 17( 25), 15393-15401. doi:10.1039/d5nr01263e

    • NLM

      Gul I, Khan ZU, Khan MA, Pasca GAC, AlZubi RI, Figueroa SJA, Brito HF de, Khan LU. Ln3+-ion-mediated enhancement in UV/X-ray-induced optical emission from Mn2+-doped ZnSe nanocrystals [Internet]. Nanoscale. 2025 ; 17( 25): 15393-15401.[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.1039/d5nr01263e

    • Vancouver

      Gul I, Khan ZU, Khan MA, Pasca GAC, AlZubi RI, Figueroa SJA, Brito HF de, Khan LU. Ln3+-ion-mediated enhancement in UV/X-ray-induced optical emission from Mn2+-doped ZnSe nanocrystals [Internet]. Nanoscale. 2025 ; 17( 25): 15393-15401.[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.1039/d5nr01263e

  • Artigo de periodico

    Unveiling peripheral symmetric acceptors coupling with tetrathienylbenzene core to promote electron transfer dynamics in organic photovoltaics (2024)

    khalid, Muhammad; Jabbar, Aiman; Murtaza, Shahzad; Arshad, Muhammad; Braga, Ataualpa Albert Carmo; Ahamad, Tansir

    Source: Scientific Reports. Unidade: IQ

    Subjects: COMPOSTOS ORGÂNICOS, CÉLULAS SOLARES

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      KHALID, Muhammad et al. Unveiling peripheral symmetric acceptors coupling with tetrathienylbenzene core to promote electron transfer dynamics in organic photovoltaics. Scientific Reports, v. 14, n. 1, p. 1-13 art. 21176, 2024Tradução . . Disponível em: https://dx.doi.org/10.1038/s41598-024-71777-6. Acesso em: 12 nov. 2025.

    • APA

      khalid, M., Jabbar, A., Murtaza, S., Arshad, M., Braga, A. A. C., & Ahamad, T. (2024). Unveiling peripheral symmetric acceptors coupling with tetrathienylbenzene core to promote electron transfer dynamics in organic photovoltaics. Scientific Reports, 14( 1), 1-13 art. 21176. doi:10.1038/s41598-024-71777-6

    • NLM

      khalid M, Jabbar A, Murtaza S, Arshad M, Braga AAC, Ahamad T. Unveiling peripheral symmetric acceptors coupling with tetrathienylbenzene core to promote electron transfer dynamics in organic photovoltaics [Internet]. Scientific Reports. 2024 ; 14( 1): 1-13 art. 21176.[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.1038/s41598-024-71777-6

    • Vancouver

      khalid M, Jabbar A, Murtaza S, Arshad M, Braga AAC, Ahamad T. Unveiling peripheral symmetric acceptors coupling with tetrathienylbenzene core to promote electron transfer dynamics in organic photovoltaics [Internet]. Scientific Reports. 2024 ; 14( 1): 1-13 art. 21176.[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.1038/s41598-024-71777-6

  • Artigo de periodico

    Exploring the photovoltaic properties of naphthalene-1,5-diamine-based functionalized materials in aprotic polar medium: a combined experimental and DFT approach (2024)

    Shafiq, Iqra ; Khalid, Muhammad ; Jawaria, Rifat; Shafiq, Zahid ; Murtaza, Shahzad; Braga, Ataualpa Albert Carmo

    Source: RSC Advances. Unidade: IQ

    Subjects: CÉLULAS SOLARES, ESPECTROSCOPIA

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    • ABNT

      SHAFIQ, Iqra et al. Exploring the photovoltaic properties of naphthalene-1,5-diamine-based functionalized materials in aprotic polar medium: a combined experimental and DFT approach. RSC Advances, v. 14, n. 45, p. 33048–33060, 2024Tradução . . Disponível em: https://dx.doi.org/10.1039/d4ra03916e. Acesso em: 12 nov. 2025.

    • APA

      Shafiq, I., Khalid, M., Jawaria, R., Shafiq, Z., Murtaza, S., & Braga, A. A. C. (2024). Exploring the photovoltaic properties of naphthalene-1,5-diamine-based functionalized materials in aprotic polar medium: a combined experimental and DFT approach. RSC Advances, 14( 45), 33048–33060. doi:10.1039/d4ra03916e

    • NLM

      Shafiq I, Khalid M, Jawaria R, Shafiq Z, Murtaza S, Braga AAC. Exploring the photovoltaic properties of naphthalene-1,5-diamine-based functionalized materials in aprotic polar medium: a combined experimental and DFT approach [Internet]. RSC Advances. 2024 ; 14( 45): 33048–33060.[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.1039/d4ra03916e

    • Vancouver

      Shafiq I, Khalid M, Jawaria R, Shafiq Z, Murtaza S, Braga AAC. Exploring the photovoltaic properties of naphthalene-1,5-diamine-based functionalized materials in aprotic polar medium: a combined experimental and DFT approach [Internet]. RSC Advances. 2024 ; 14( 45): 33048–33060.[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.1039/d4ra03916e

  • 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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    • ABNT

      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: 12 nov. 2025.

    • APA

      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 2025 nov. 12 ] 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 2025 nov. 12 ] Available from: https://dx.doi.org/10.1016/j.mssp.2024.108695

  • 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, Rajeh; Chen, Ke

    Source: Journal of Saudi Chemical Society. Unidade: IQ

    Subjects: ORBITAL MOLECULAR, CONVERSÃO DE ENERGIA ELÉTRICA, CÉLULAS SOLARES

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    • ABNT

      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: 12 nov. 2025.

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      Khalid, M., Jamal, S., Braga, A. A. C., Haroon, M., Alotaibi, 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 R, 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 2025 nov. 12 ] Available from: https://dx.doi.org/10.1016/j.jscs.2024.101903

    • Vancouver

      Khalid M, Jamal S, Braga AAC, Haroon M, Alotaibi R, 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 2025 nov. 12 ] Available from: https://dx.doi.org/10.1016/j.jscs.2024.101903

  • 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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    • ABNT

      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: 12 nov. 2025.

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      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 2025 nov. 12 ] 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 2025 nov. 12 ] Available from: https://dx.doi.org/10.1016/j.molliq.2023.123569

  • 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: 12 nov. 2025.

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      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 2025 nov. 12 ] 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 2025 nov. 12 ] Available from: https://dx.doi.org/10.1016/j.molliq.2024.124608

  • 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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    • ABNT

      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: 12 nov. 2025.

    • APA

      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 2025 nov. 12 ] 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 2025 nov. 12 ] Available from: https://dx.doi.org/10.1016/j.microc.2024.110690

  • Artigo de periodico

    Amplifying the photovoltaic properties of tetrathiafulvalenes based materials by incorporation of small acceptors: a density functional theory approach (2024)

    khalid, Muhammad; Tariq, Ayesha; Braga, Ataualpa Albert Carmo ; Alotaibi, Rajeh; Ojha, Suvash Chandra

    Source: Scientific Reports. Unidade: IQ

    Subjects: COMPOSTOS AROMÁTICOS, CÉLULAS SOLARES, QUÍMICA TEÓRICA, ENGENHARIA QUÍMICA

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    • ABNT

      KHALID, Muhammad et al. Amplifying the photovoltaic properties of tetrathiafulvalenes based materials by incorporation of small acceptors: a density functional theory approach. Scientific Reports, v. 14, p. 1-15 art. 24213, 2024Tradução . . Disponível em: https://dx.doi.org/10.1038/s41598-024-74852-0. Acesso em: 12 nov. 2025.

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      khalid, M., Tariq, A., Braga, A. A. C., Alotaibi, R., & Ojha, S. C. (2024). Amplifying the photovoltaic properties of tetrathiafulvalenes based materials by incorporation of small acceptors: a density functional theory approach. Scientific Reports, 14, 1-15 art. 24213. doi:10.1038/s41598-024-74852-0

    • NLM

      khalid M, Tariq A, Braga AAC, Alotaibi R, Ojha SC. Amplifying the photovoltaic properties of tetrathiafulvalenes based materials by incorporation of small acceptors: a density functional theory approach [Internet]. Scientific Reports. 2024 ; 14 1-15 art. 24213.[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.1038/s41598-024-74852-0

    • Vancouver

      khalid M, Tariq A, Braga AAC, Alotaibi R, Ojha SC. Amplifying the photovoltaic properties of tetrathiafulvalenes based materials by incorporation of small acceptors: a density functional theory approach [Internet]. Scientific Reports. 2024 ; 14 1-15 art. 24213.[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.1038/s41598-024-74852-0

  • Artigo de periodico

    Exploration of the effect of multiple acceptor and π–spacer moieties coupled to indolonaphthyridine core for promising organic photovoltaic properties: a first principles framework (2024)

    Khan, Mashal; khalid, Muhammad; Murtaza, Shahzad; Braga, Ataualpa Albert Carmo ; Alrashidi, Khalid Abdullah; Ahmed, Sarfraz

    Source: Scientific Reports. Unidade: IQ

    Subjects: CÉLULAS SOLARES, FULERENO

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    • ABNT

      KHAN, Mashal et al. Exploration of the effect of multiple acceptor and π–spacer moieties coupled to indolonaphthyridine core for promising organic photovoltaic properties: a first principles framework. Scientific Reports, v. 14, p. 1-21 art. 19820, 2024Tradução . . Disponível em: https://dx.doi.org/10.1038/s41598-024-70457-9. Acesso em: 12 nov. 2025.

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      Khan, M., khalid, M., Murtaza, S., Braga, A. A. C., Alrashidi, K. A., & Ahmed, S. (2024). Exploration of the effect of multiple acceptor and π–spacer moieties coupled to indolonaphthyridine core for promising organic photovoltaic properties: a first principles framework. Scientific Reports, 14, 1-21 art. 19820. doi:10.1038/s41598-024-70457-9

    • NLM

      Khan M, khalid M, Murtaza S, Braga AAC, Alrashidi KA, Ahmed S. Exploration of the effect of multiple acceptor and π–spacer moieties coupled to indolonaphthyridine core for promising organic photovoltaic properties: a first principles framework [Internet]. Scientific Reports. 2024 ; 14 1-21 art. 19820.[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.1038/s41598-024-70457-9

    • Vancouver

      Khan M, khalid M, Murtaza S, Braga AAC, Alrashidi KA, Ahmed S. Exploration of the effect of multiple acceptor and π–spacer moieties coupled to indolonaphthyridine core for promising organic photovoltaic properties: a first principles framework [Internet]. Scientific Reports. 2024 ; 14 1-21 art. 19820.[citado 2025 nov. 12 ] Available from: https://dx.doi.org/10.1038/s41598-024-70457-9

  • Artigo de periodico

    Enhanced label-free detection of proteins on Au nanoparticle micropatterns for surface-enhanced infrared absorption spectroscopy (2024)

    Hassan, Ayaz ; Sousa, Daniel da Silva de ; Bertaglia, Thiago ; Crespilho, Frank Nelson

    Source: Chemical Communications. Unidade: IQSC

    Subjects: PROTEÍNAS, NANOPARTÍCULAS, ESPECTROSCOPIA ATÔMICA

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    • ABNT

      HASSAN, Ayaz et al. Enhanced label-free detection of proteins on Au nanoparticle micropatterns for surface-enhanced infrared absorption spectroscopy. Chemical Communications, v. 60, p. 7212, 2024Tradução . . Disponível em: https://doi.org/10.1039/d4cc01320d. Acesso em: 12 nov. 2025.

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      Hassan, A., Sousa, D. da S. de, Bertaglia, T., & Crespilho, F. N. (2024). Enhanced label-free detection of proteins on Au nanoparticle micropatterns for surface-enhanced infrared absorption spectroscopy. Chemical Communications, 60, 7212. doi:10.1039/d4cc01320d

    • NLM

      Hassan A, Sousa D da S de, Bertaglia T, Crespilho FN. Enhanced label-free detection of proteins on Au nanoparticle micropatterns for surface-enhanced infrared absorption spectroscopy [Internet]. Chemical Communications. 2024 ;60 7212.[citado 2025 nov. 12 ] Available from: https://doi.org/10.1039/d4cc01320d

    • Vancouver

      Hassan A, Sousa D da S de, Bertaglia T, Crespilho FN. Enhanced label-free detection of proteins on Au nanoparticle micropatterns for surface-enhanced infrared absorption spectroscopy [Internet]. Chemical Communications. 2024 ;60 7212.[citado 2025 nov. 12 ] Available from: https://doi.org/10.1039/d4cc01320d

  • 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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    • ABNT

      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: 12 nov. 2025.

    • 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 2025 nov. 12 ] 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 2025 nov. 12 ] Available from: https://dx.doi.org/10.1080/10406638.2023.2235871

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