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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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ABNT
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: 03 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. 03 ] 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. 03 ] 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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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: 03 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. 03 ] 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. 03 ] Available from: https://dx.doi.org/10.1021/acs.iecr.3c04133
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: 03 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. 03 ] 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. 03 ] Available from: https://dx.doi.org/10.1039/d4ra03170a
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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ABNT
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: 03 ago. 2024.
APA
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. 03 ] 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. 03 ] Available from: https://dx.doi.org/10.1039/d3ra06817j
Artigo de periodico
Exploration of nonlinear optical enhancement in acceptor-π-donor indacenodithiophene based derivatives via structural variations: a DFT approach (2023)
Abid, Saba; Khalid, Muhammad ; Sagir, Muhammad; Imran, Muhammad ; Braga, Ataualpa Albert Carmo ; Ojha, Suvash Chandra
Source: RSC Advances. Unidade: IQ
Subjects: ÓPTICA NÃO LINEAR, LIGAÇÕES QUÍMICAS
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ABNT
ABID, Saba et al. Exploration of nonlinear optical enhancement in acceptor-π-donor indacenodithiophene based derivatives via structural variations: a DFT approach. RSC Advances, v. 13, p. 28076–28088, 2023Tradução . . Disponível em: https://dx.doi.org/10.1039/d3ra04858f. Acesso em: 03 ago. 2024.
APA
Abid, S., Khalid, M., Sagir, M., Imran, M., Braga, A. A. C., & Ojha, S. C. (2023). Exploration of nonlinear optical enhancement in acceptor-π-donor indacenodithiophene based derivatives via structural variations: a DFT approach. RSC Advances, 13, 28076–28088. doi:10.1039/d3ra04858f
NLM
Abid S, Khalid M, Sagir M, Imran M, Braga AAC, Ojha SC. Exploration of nonlinear optical enhancement in acceptor-π-donor indacenodithiophene based derivatives via structural variations: a DFT approach [Internet]. RSC Advances. 2023 ; 13 28076–28088.[citado 2024 ago. 03 ] Available from: https://dx.doi.org/10.1039/d3ra04858f
Vancouver
Abid S, Khalid M, Sagir M, Imran M, Braga AAC, Ojha SC. Exploration of nonlinear optical enhancement in acceptor-π-donor indacenodithiophene based derivatives via structural variations: a DFT approach [Internet]. RSC Advances. 2023 ; 13 28076–28088.[citado 2024 ago. 03 ] Available from: https://dx.doi.org/10.1039/d3ra04858f
Artigo de periodico
Design, synthesis, and density functional theory studies of indole Hydrazones as colorimetric “naked eye” Sensors for F ions (2023)
Alharthy, Rima D; Ahmed, Nadeem; Mubarak, Saman; Yaqub, Muhammad; Khalid, Muhammad ; Shafiq, Iqra ; Asghar, Muhammad Adnan; Braga, Ataualpa Albert Carmo ; Shafiq, Zahid
Source: ACS Omega. Unidade: IQ
Subjects: ÍONS, FLUORESCÊNCIA
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ABNT
ALHARTHY, Rima D et al. Design, synthesis, and density functional theory studies of indole Hydrazones as colorimetric “naked eye” Sensors for F ions. ACS Omega, v. 8, n. 15, p. 14131–14143, 2023Tradução . . Disponível em: https://doi.org/10.1021/acsomega.3c00821. Acesso em: 03 ago. 2024.
APA
Alharthy, R. D., Ahmed, N., Mubarak, S., Yaqub, M., Khalid, M., Shafiq, I., et al. (2023). Design, synthesis, and density functional theory studies of indole Hydrazones as colorimetric “naked eye” Sensors for F ions. ACS Omega, 8( 15), 14131–14143. doi:10.1021/acsomega.3c00821
NLM
Alharthy RD, Ahmed N, Mubarak S, Yaqub M, Khalid M, Shafiq I, Asghar MA, Braga AAC, Shafiq Z. Design, synthesis, and density functional theory studies of indole Hydrazones as colorimetric “naked eye” Sensors for F ions [Internet]. ACS Omega. 2023 ; 8( 15): 14131–14143.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1021/acsomega.3c00821
Vancouver
Alharthy RD, Ahmed N, Mubarak S, Yaqub M, Khalid M, Shafiq I, Asghar MA, Braga AAC, Shafiq Z. Design, synthesis, and density functional theory studies of indole Hydrazones as colorimetric “naked eye” Sensors for F ions [Internet]. ACS Omega. 2023 ; 8( 15): 14131–14143.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1021/acsomega.3c00821
Artigo de periodico
Role of donors in triggering second order non-linear optical properties of non-fullerene FCO-2FR1 based derivatives: a theoretical perspective (2023)
Khalid, Muhammad ; Khan, Mashal; Shafiq, Iqra ; Mahmood, Khalid; Akhtar, Muhammad Nadeem ; Iqbal, Javed; Al-Sadoon, Mohammad Khalid; Zaman, Wajid; Braga, Ataualpa Albert Carmo
Source: Heliyon. Unidade: IQ
Subjects: DIFRAÇÃO POR RAIOS X, COMPOSTOS ORGÂNICOS
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ABNT
KHALID, Muhammad et al. Role of donors in triggering second order non-linear optical properties of non-fullerene FCO-2FR1 based derivatives: a theoretical perspective. Heliyon, v. 9, p. 1-19 art. e13033, 2023Tradução . . Disponível em: https://doi.org/10.1016/j.heliyon.2023.e13033. Acesso em: 03 ago. 2024.
APA
Khalid, M., Khan, M., Shafiq, I., Mahmood, K., Akhtar, M. N., Iqbal, J., et al. (2023). Role of donors in triggering second order non-linear optical properties of non-fullerene FCO-2FR1 based derivatives: a theoretical perspective. Heliyon, 9, 1-19 art. e13033. doi:10.1016/j.heliyon.2023.e13033
NLM
Khalid M, Khan M, Shafiq I, Mahmood K, Akhtar MN, Iqbal J, Al-Sadoon MK, Zaman W, Braga AAC. Role of donors in triggering second order non-linear optical properties of non-fullerene FCO-2FR1 based derivatives: a theoretical perspective [Internet]. Heliyon. 2023 ; 9 1-19 art. e13033.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1016/j.heliyon.2023.e13033
Vancouver
Khalid M, Khan M, Shafiq I, Mahmood K, Akhtar MN, Iqbal J, Al-Sadoon MK, Zaman W, Braga AAC. Role of donors in triggering second order non-linear optical properties of non-fullerene FCO-2FR1 based derivatives: a theoretical perspective [Internet]. Heliyon. 2023 ; 9 1-19 art. e13033.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1016/j.heliyon.2023.e13033
Artigo de periodico
Influence of peripheral modification of electron acceptors in nonfullerene (O-IDTBR1)-based derivatives on nonlinear optical response: DFT/TDDFT study (2022)
Arshad, Muhammad Nadeem ; Khalid, Muhammad ; Asad, Mohammad; Braga, Ataualpa Albert Carmo ; Asiri, Abdullah M ; Alotaibi, Maha M
Source: ACS Omega. Unidade: IQ
Subjects: MOLÉCULA, ÓPTICA, COMPOSTOS ORGÂNICOS
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ABNT
ARSHAD, Muhammad Nadeem et al. Influence of peripheral modification of electron acceptors in nonfullerene (O-IDTBR1)-based derivatives on nonlinear optical response: DFT/TDDFT study. ACS Omega, v. 7, p. 11631−11642, 2022Tradução . . Disponível em: https://doi.org/10.1021/acsomega.1c06320. Acesso em: 03 ago. 2024.
APA
Arshad, M. N., Khalid, M., Asad, M., Braga, A. A. C., Asiri, A. M., & Alotaibi, M. M. (2022). Influence of peripheral modification of electron acceptors in nonfullerene (O-IDTBR1)-based derivatives on nonlinear optical response: DFT/TDDFT study. ACS Omega, 7, 11631−11642. doi:10.1021/acsomega.1c06320
NLM
Arshad MN, Khalid M, Asad M, Braga AAC, Asiri AM, Alotaibi MM. Influence of peripheral modification of electron acceptors in nonfullerene (O-IDTBR1)-based derivatives on nonlinear optical response: DFT/TDDFT study [Internet]. ACS Omega. 2022 ; 7 11631−11642.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1021/acsomega.1c06320
Vancouver
Arshad MN, Khalid M, Asad M, Braga AAC, Asiri AM, Alotaibi MM. Influence of peripheral modification of electron acceptors in nonfullerene (O-IDTBR1)-based derivatives on nonlinear optical response: DFT/TDDFT study [Internet]. ACS Omega. 2022 ; 7 11631−11642.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1021/acsomega.1c06320
Artigo de periodico
Novel quinoline-derived chemosensors: synthesis, anion recognition, spectroscopic, and computational study (2022)
Saleem, Tahira; Khan, Samra; Yaqub, Muhammad; Khalid, Muhammad ; Islam, Muhammad; Rehman, Muhammad Yousaf ur; Rashid, Muhammad; Shafiq, Iqra; Braga, Ataualpa Albert Carmo ; Syed, Asad; Bahkali, Ali H; Trant, John F ; Shafiq, Zahid
Source: New Journal of Chemistry. Unidade: IQ
Subjects: VOLTAMETRIA, FLUORESCÊNCIA
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ABNT
SALEEM, Tahira et al. Novel quinoline-derived chemosensors: synthesis, anion recognition, spectroscopic, and computational study. New Journal of Chemistry, v. 46, p. 18233-18243, 2022Tradução . . Disponível em: https://doi.org/10.1039/D2NJ02666J. Acesso em: 03 ago. 2024.
APA
Saleem, T., Khan, S., Yaqub, M., Khalid, M., Islam, M., Rehman, M. Y. ur, et al. (2022). Novel quinoline-derived chemosensors: synthesis, anion recognition, spectroscopic, and computational study. New Journal of Chemistry, 46, 18233-18243. doi:10.1039/D2NJ02666J
NLM
Saleem T, Khan S, Yaqub M, Khalid M, Islam M, Rehman MY ur, Rashid M, Shafiq I, Braga AAC, Syed A, Bahkali AH, Trant JF, Shafiq Z. Novel quinoline-derived chemosensors: synthesis, anion recognition, spectroscopic, and computational study [Internet]. New Journal of Chemistry. 2022 ; 46 18233-18243.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1039/D2NJ02666J
Vancouver
Saleem T, Khan S, Yaqub M, Khalid M, Islam M, Rehman MY ur, Rashid M, Shafiq I, Braga AAC, Syed A, Bahkali AH, Trant JF, Shafiq Z. Novel quinoline-derived chemosensors: synthesis, anion recognition, spectroscopic, and computational study [Internet]. New Journal of Chemistry. 2022 ; 46 18233-18243.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1039/D2NJ02666J
Artigo de periodico
Exploration of the interesting photovoltaic behavior of the fused benzothiophene dioxide moiety as a core donor with modification in acceptors for high-efficacy organic solar cells (2022)
Khalid, Muhammad; Anwer, Wajeeha; Adeel, Muhammad; Shafiq, Zahid ; Braga, Ataualpa Albert Carmo ; Assiri, Mohammed; Imran, Muhammad ; Ullah, Aman
Source: RSC advances. Unidade: IQ
Subjects: CÉLULAS SOLARES, COMPOSTOS ORGÂNICOS
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ABNT
KHALID, Muhammad et al. Exploration of the interesting photovoltaic behavior of the fused benzothiophene dioxide moiety as a core donor with modification in acceptors for high-efficacy organic solar cells. RSC advances, v. 12, p. 29010–29021 art. 29010, 2022Tradução . . Disponível em: https://doi.org/10.1039/d2ra04473k. Acesso em: 03 ago. 2024.
APA
Khalid, M., Anwer, W., Adeel, M., Shafiq, Z., Braga, A. A. C., Assiri, M., et al. (2022). Exploration of the interesting photovoltaic behavior of the fused benzothiophene dioxide moiety as a core donor with modification in acceptors for high-efficacy organic solar cells. RSC advances, 12, 29010–29021 art. 29010. doi:10.1039/d2ra04473k
NLM
Khalid M, Anwer W, Adeel M, Shafiq Z, Braga AAC, Assiri M, Imran M, Ullah A. Exploration of the interesting photovoltaic behavior of the fused benzothiophene dioxide moiety as a core donor with modification in acceptors for high-efficacy organic solar cells [Internet]. RSC advances. 2022 ; 12 29010–29021 art. 29010.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1039/d2ra04473k
Vancouver
Khalid M, Anwer W, Adeel M, Shafiq Z, Braga AAC, Assiri M, Imran M, Ullah A. Exploration of the interesting photovoltaic behavior of the fused benzothiophene dioxide moiety as a core donor with modification in acceptors for high-efficacy organic solar cells [Internet]. RSC advances. 2022 ; 12 29010–29021 art. 29010.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1039/d2ra04473k
Artigo de periodico
Synthesis, nonlinear optical analysis and DFT studies of D–π–D and A–π–A configured Schiff bases derived from bis-phenylenediamine (2022)
Farooq, Rabia; Batool, Zahra; Khalid, Muhammad; Khan, Muhammad Usman ; Braga, Ataualpa Albert Carmo ; Ragab, Ahmed H; Al-Mhyawi, Saedah R ; Muhammad, Gulzar ; Shafiq, Zahid
Source: RSC Advances. Unidade: IQ
Subjects: ANÁLISE ÓTICA, COMPOSTOS ORGÂNICOS
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ABNT
FAROOQ, Rabia et al. Synthesis, nonlinear optical analysis and DFT studies of D–π–D and A–π–A configured Schiff bases derived from bis-phenylenediamine. RSC Advances, v. 12, p. 32185–32196, 2022Tradução . . Disponível em: https://doi.org/10.1039/d2ra05844h. Acesso em: 03 ago. 2024.
APA
Farooq, R., Batool, Z., Khalid, M., Khan, M. U., Braga, A. A. C., Ragab, A. H., et al. (2022). Synthesis, nonlinear optical analysis and DFT studies of D–π–D and A–π–A configured Schiff bases derived from bis-phenylenediamine. RSC Advances, 12, 32185–32196. doi:10.1039/d2ra05844h
NLM
Farooq R, Batool Z, Khalid M, Khan MU, Braga AAC, Ragab AH, Al-Mhyawi SR, Muhammad G, Shafiq Z. Synthesis, nonlinear optical analysis and DFT studies of D–π–D and A–π–A configured Schiff bases derived from bis-phenylenediamine [Internet]. RSC Advances. 2022 ; 12 32185–32196.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1039/d2ra05844h
Vancouver
Farooq R, Batool Z, Khalid M, Khan MU, Braga AAC, Ragab AH, Al-Mhyawi SR, Muhammad G, Shafiq Z. Synthesis, nonlinear optical analysis and DFT studies of D–π–D and A–π–A configured Schiff bases derived from bis-phenylenediamine [Internet]. RSC Advances. 2022 ; 12 32185–32196.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1039/d2ra05844h
Artigo de periodico
First theoretical probe for efficient enhancement of optical nonlinearity via structural modifications into phenylene based D–π–A configured molecules (2022)
Khalid, Muhammad ; Naz, Salma; Mahmood, Khalid; Hussain, Shabbir ; Braga, Ataualpa Albert Carmo ; Hussain, Riaz ; Ragab, Ahmed H; Al-Mhyawi, Saedah R
Source: RSC Advances. Unidade: IQ
Subjects: MATERIAIS ÓPTICOS, COMPOSTOS ORGÂNICOS
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ABNT
KHALID, Muhammad et al. First theoretical probe for efficient enhancement of optical nonlinearity via structural modifications into phenylene based D–π–A configured molecules. RSC Advances, v. 12, p. 31192–31204 : + Supplentary materials ( S1-S47), 2022Tradução . . Disponível em: https://doi.org/10.1039/d2ra04844b. Acesso em: 03 ago. 2024.
APA
Khalid, M., Naz, S., Mahmood, K., Hussain, S., Braga, A. A. C., Hussain, R., et al. (2022). First theoretical probe for efficient enhancement of optical nonlinearity via structural modifications into phenylene based D–π–A configured molecules. RSC Advances, 12, 31192–31204 : + Supplentary materials ( S1-S47). doi:10.1039/d2ra04844b
NLM
Khalid M, Naz S, Mahmood K, Hussain S, Braga AAC, Hussain R, Ragab AH, Al-Mhyawi SR. First theoretical probe for efficient enhancement of optical nonlinearity via structural modifications into phenylene based D–π–A configured molecules [Internet]. RSC Advances. 2022 ; 12 31192–31204 : + Supplentary materials ( S1-S47).[citado 2024 ago. 03 ] Available from: https://doi.org/10.1039/d2ra04844b
Vancouver
Khalid M, Naz S, Mahmood K, Hussain S, Braga AAC, Hussain R, Ragab AH, Al-Mhyawi SR. First theoretical probe for efficient enhancement of optical nonlinearity via structural modifications into phenylene based D–π–A configured molecules [Internet]. RSC Advances. 2022 ; 12 31192–31204 : + Supplentary materials ( S1-S47).[citado 2024 ago. 03 ] Available from: https://doi.org/10.1039/d2ra04844b
Artigo de periodico
Donor moieties with D–π–a framing modulated electronic and nonlinear optical properties for nonfullerene- based chromophores (2022)
Arshad, Muhammad Nadeem; Khalid, Muhammad ; shabbir, Ghulam; Mohammad Asad; Asiri, Abdullah M ; Alotaibi, Maha M; Braga, Ataualpa Albert Carmo ; Khan, Anish
Source: RSC Advances. Unidade: IQ
Subjects: FULERENO, QUÍMICA QUÂNTICA
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ABNT
ARSHAD, Muhammad Nadeem et al. Donor moieties with D–π–a framing modulated electronic and nonlinear optical properties for nonfullerene- based chromophores. RSC Advances, v. 12, n. 7, p. 4209–4223, 2022Tradução . . Disponível em: https://doi.org/10.1039/d1ra07183a. Acesso em: 03 ago. 2024.
APA
Arshad, M. N., Khalid, M., shabbir, G., Mohammad Asad,, Asiri, A. M., Alotaibi, M. M., et al. (2022). Donor moieties with D–π–a framing modulated electronic and nonlinear optical properties for nonfullerene- based chromophores. RSC Advances, 12( 7), 4209–4223. doi:10.1039/d1ra07183a
NLM
Arshad MN, Khalid M, shabbir G, Mohammad Asad, Asiri AM, Alotaibi MM, Braga AAC, Khan A. Donor moieties with D–π–a framing modulated electronic and nonlinear optical properties for nonfullerene- based chromophores [Internet]. RSC Advances. 2022 ; 12( 7): 4209–4223.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1039/d1ra07183a
Vancouver
Arshad MN, Khalid M, shabbir G, Mohammad Asad, Asiri AM, Alotaibi MM, Braga AAC, Khan A. Donor moieties with D–π–a framing modulated electronic and nonlinear optical properties for nonfullerene- based chromophores [Internet]. RSC Advances. 2022 ; 12( 7): 4209–4223.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1039/d1ra07183a
Artigo de periodico
Exploration of photophysical and nonlinear properties of Salicylaldehyde-based functionalized materials: a facile synthetic and DFT approach (2021)
Imran, Muhammad; Khalid, Muhammad ; Jawaria, Rifat; Ali, Asif; Asghar, Muhammad Adnan; Shafiq, Zahid ; Assiri, Mohammed A; Lodhi, Hafiza Munazza; Braga, Ataualpa Albert Carmo
Source: ACS Omega. Unidade: IQ
Subjects: MOLÉCULA, ESPECTROSCOPIA, ÓPTICA NÃO LINEAR, GEOMETRIA E MODELAGEM COMPUTACIONAL
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
IMRAN, Muhammad et al. Exploration of photophysical and nonlinear properties of Salicylaldehyde-based functionalized materials: a facile synthetic and DFT approach. ACS Omega, v. 6, p. 33914−33922, 2021Tradução . . Disponível em: https://doi.org/10.1021/acsomega.1c04984. Acesso em: 03 ago. 2024.
APA
Imran, M., Khalid, M., Jawaria, R., Ali, A., Asghar, M. A., Shafiq, Z., et al. (2021). Exploration of photophysical and nonlinear properties of Salicylaldehyde-based functionalized materials: a facile synthetic and DFT approach. ACS Omega, 6, 33914−33922. doi:10.1021/acsomega.1c04984
NLM
Imran M, Khalid M, Jawaria R, Ali A, Asghar MA, Shafiq Z, Assiri MA, Lodhi HM, Braga AAC. Exploration of photophysical and nonlinear properties of Salicylaldehyde-based functionalized materials: a facile synthetic and DFT approach [Internet]. ACS Omega. 2021 ; 6 33914−33922.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1021/acsomega.1c04984
Vancouver
Imran M, Khalid M, Jawaria R, Ali A, Asghar MA, Shafiq Z, Assiri MA, Lodhi HM, Braga AAC. Exploration of photophysical and nonlinear properties of Salicylaldehyde-based functionalized materials: a facile synthetic and DFT approach [Internet]. ACS Omega. 2021 ; 6 33914−33922.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1021/acsomega.1c04984
Artigo de periodico
Facile synthesis of diversely functionalized Peptoids, spectroscopic characterization, and DFT-Based nonlinear optical exploration (2021)
Concepcion, Odette; Ali, Akbar ; Khalid, Muhammad ; Torre, Alexander F. de la ; Khan, Muhammad Usman ; Raza, Abdul Rauf; Kamal, Ghulam Mustafa; Rehman, Muhammad Fayyaz ur; Alam, Mohammed Mujahid; Imran, Muhammad; Braga, Ataualpa Albert Carmo ; Pertino, Mariano W
Source: ACS Omega. Unidade: IQ
Subjects: PEPTÍDEOS, ESPECTROSCOPIA
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ABNT
CONCEPCION, Odette et al. Facile synthesis of diversely functionalized Peptoids, spectroscopic characterization, and DFT-Based nonlinear optical exploration. ACS Omega, v. 6, n. 40, p. 26016−26025, 2021Tradução . . Disponível em: https://doi.org/10.1021/acsomega.1c02962. Acesso em: 03 ago. 2024.
APA
Concepcion, O., Ali, A., Khalid, M., Torre, A. F. de la, Khan, M. U., Raza, A. R., et al. (2021). Facile synthesis of diversely functionalized Peptoids, spectroscopic characterization, and DFT-Based nonlinear optical exploration. ACS Omega, 6( 40), 26016−26025. doi:10.1021/acsomega.1c02962
NLM
Concepcion O, Ali A, Khalid M, Torre AF de la, Khan MU, Raza AR, Kamal GM, Rehman MF ur, Alam MM, Imran M, Braga AAC, Pertino MW. Facile synthesis of diversely functionalized Peptoids, spectroscopic characterization, and DFT-Based nonlinear optical exploration [Internet]. ACS Omega. 2021 ; 6( 40): 26016−26025.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1021/acsomega.1c02962
Vancouver
Concepcion O, Ali A, Khalid M, Torre AF de la, Khan MU, Raza AR, Kamal GM, Rehman MF ur, Alam MM, Imran M, Braga AAC, Pertino MW. Facile synthesis of diversely functionalized Peptoids, spectroscopic characterization, and DFT-Based nonlinear optical exploration [Internet]. ACS Omega. 2021 ; 6( 40): 26016−26025.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1021/acsomega.1c02962
Artigo de periodico
An efficient synthesis, spectroscopic characterization, and optical nonlinearity response of novel salicylaldehyde thiosemicarbazone derivatives (2021)
Khalid, Muhammad ; Jawaria, Rifat; Khan, Muhammad Usman; Braga, Ataualpa Albert Carmo ; Shafiq, Zahid ; Imran, Muhammad; Zafar, Hafiz Muhammad Ahmad; Irfan, Ahmad
Source: ACS Omega. Unidade: IQ
Subjects: ÓPTICA NÃO LINEAR, ESPECTROSCOPIA ÓPTICA
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
KHALID, Muhammad et al. An efficient synthesis, spectroscopic characterization, and optical nonlinearity response of novel salicylaldehyde thiosemicarbazone derivatives. ACS Omega, v. 6, n. 24 p. 16058–16065, 2021Tradução . . Disponível em: https://doi.org/10.1021/acsomega.1c01938. Acesso em: 03 ago. 2024.
APA
Khalid, M., Jawaria, R., Khan, M. U., Braga, A. A. C., Shafiq, Z., Imran, M., et al. (2021). An efficient synthesis, spectroscopic characterization, and optical nonlinearity response of novel salicylaldehyde thiosemicarbazone derivatives. ACS Omega, 6( 24 p. 16058–16065). doi:10.1021/acsomega.1c01938
NLM
Khalid M, Jawaria R, Khan MU, Braga AAC, Shafiq Z, Imran M, Zafar HMA, Irfan A. An efficient synthesis, spectroscopic characterization, and optical nonlinearity response of novel salicylaldehyde thiosemicarbazone derivatives [Internet]. ACS Omega. 2021 ; 6( 24 p. 16058–16065):[citado 2024 ago. 03 ] Available from: https://doi.org/10.1021/acsomega.1c01938
Vancouver
Khalid M, Jawaria R, Khan MU, Braga AAC, Shafiq Z, Imran M, Zafar HMA, Irfan A. An efficient synthesis, spectroscopic characterization, and optical nonlinearity response of novel salicylaldehyde thiosemicarbazone derivatives [Internet]. ACS Omega. 2021 ; 6( 24 p. 16058–16065):[citado 2024 ago. 03 ] Available from: https://doi.org/10.1021/acsomega.1c01938
Artigo de periodico
Exploration of chromone-based thiosemicarbazone derivatives: SC-XRD/DFT, spectral (IR, UV–Vis) characterization, and quantum chemical analysis (2020)
Rabia Basri; Khalid, Muhammad ; Shafiq, Zahid ; Tahir, Muhammad Suleman; Khan, Muhammad Usman; Tahir, Muhammad Nawaz; Naseer, Muhammad Moazzam; Braga, Ataualpa Albert Carmo
Source: ACS Omega. Unidade: IQ
Subjects: QUÍMICA QUÂNTICA, CROMO
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
RABIA BASRI, et al. Exploration of chromone-based thiosemicarbazone derivatives: SC-XRD/DFT, spectral (IR, UV–Vis) characterization, and quantum chemical analysis. ACS Omega, v. 5, n. 46, p. 30176–30188, 2020Tradução . . Disponível em: https://doi.org/10.1021/acsomega.0c04653. Acesso em: 03 ago. 2024.
APA
Rabia Basri,, Khalid, M., Shafiq, Z., Tahir, M. S., Khan, M. U., Tahir, M. N., et al. (2020). Exploration of chromone-based thiosemicarbazone derivatives: SC-XRD/DFT, spectral (IR, UV–Vis) characterization, and quantum chemical analysis. ACS Omega, 5( 46), 30176–30188. doi:10.1021/acsomega.0c04653
NLM
Rabia Basri, Khalid M, Shafiq Z, Tahir MS, Khan MU, Tahir MN, Naseer MM, Braga AAC. Exploration of chromone-based thiosemicarbazone derivatives: SC-XRD/DFT, spectral (IR, UV–Vis) characterization, and quantum chemical analysis [Internet]. ACS Omega. 2020 ; 5( 46): 30176–30188.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1021/acsomega.0c04653
Vancouver
Rabia Basri, Khalid M, Shafiq Z, Tahir MS, Khan MU, Tahir MN, Naseer MM, Braga AAC. Exploration of chromone-based thiosemicarbazone derivatives: SC-XRD/DFT, spectral (IR, UV–Vis) characterization, and quantum chemical analysis [Internet]. ACS Omega. 2020 ; 5( 46): 30176–30188.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1021/acsomega.0c04653
Artigo de periodico
An experimental and computational exploration on the electronic, spectroscopic, and reactivity properties of novel halo-functionalized hydrazones (2020)
Ali, Akbar ; Khalid, Muhammad; Anwar, Farooq; Aabidin, Hafiz Zain-Ul; Akhtar, Muhammad Nadeem ; Khan, Muhammad Usman; Braga, Ataualpa Albert Carmo ; Assiri, Mohammed A; Imran, Muhammad
Source: ACS Omega. Unidade: IQ
Subjects: COMPOSTOS ORGÂNICOS, QUÍMICA, COMPOSTOS HETEROCÍCLICOS
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ABNT
ALI, Akbar et al. An experimental and computational exploration on the electronic, spectroscopic, and reactivity properties of novel halo-functionalized hydrazones. ACS Omega, v. 5, p. 18907−18918, 2020Tradução . . Disponível em: https://doi.org/10.1021/acsomega.0c02128. Acesso em: 03 ago. 2024.
APA
Ali, A., Khalid, M., Anwar, F., Aabidin, H. Z. -U., Akhtar, M. N., Khan, M. U., et al. (2020). An experimental and computational exploration on the electronic, spectroscopic, and reactivity properties of novel halo-functionalized hydrazones. ACS Omega, 5, 18907−18918. doi:10.1021/acsomega.0c02128
NLM
Ali A, Khalid M, Anwar F, Aabidin HZ-U, Akhtar MN, Khan MU, Braga AAC, Assiri MA, Imran M. An experimental and computational exploration on the electronic, spectroscopic, and reactivity properties of novel halo-functionalized hydrazones [Internet]. ACS Omega. 2020 ; 5 18907−18918.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1021/acsomega.0c02128
Vancouver
Ali A, Khalid M, Anwar F, Aabidin HZ-U, Akhtar MN, Khan MU, Braga AAC, Assiri MA, Imran M. An experimental and computational exploration on the electronic, spectroscopic, and reactivity properties of novel halo-functionalized hydrazones [Internet]. ACS Omega. 2020 ; 5 18907−18918.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1021/acsomega.0c02128
Artigo de periodico
Synthesis, characterization, and biological screening of metal complexes of novel sulfonamide derivatives: experimental and theoretical analysis of sulfonamide crystal (2020)
Sumrra, Sajjad H; Hassan, Abrar U; Imran, Muhammad; Khalid, Muhammad ; Mughal, Ehsan U; Zafar, Muhammad N; Tahir, Muhammad N; Raza, Muhammad A; Braga, Ataualpa Albert Carmo
Source: Applied Organometallic Chemistry. Unidade: IQ
Subjects: SULFONAMIDAS, METAIS
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
SUMRRA, Sajjad H et al. Synthesis, characterization, and biological screening of metal complexes of novel sulfonamide derivatives: experimental and theoretical analysis of sulfonamide crystal. Applied Organometallic Chemistry, v. 2020, p. 1-19 art. e5623 : + Supplementary materials ( S1-S9), 2020Tradução . . Disponível em: https://doi.org/10.1002/aoc.5623. Acesso em: 03 ago. 2024.
APA
Sumrra, S. H., Hassan, A. U., Imran, M., Khalid, M., Mughal, E. U., Zafar, M. N., et al. (2020). Synthesis, characterization, and biological screening of metal complexes of novel sulfonamide derivatives: experimental and theoretical analysis of sulfonamide crystal. Applied Organometallic Chemistry, 2020, 1-19 art. e5623 : + Supplementary materials ( S1-S9). doi:10.1002/aoc.5623
NLM
Sumrra SH, Hassan AU, Imran M, Khalid M, Mughal EU, Zafar MN, Tahir MN, Raza MA, Braga AAC. Synthesis, characterization, and biological screening of metal complexes of novel sulfonamide derivatives: experimental and theoretical analysis of sulfonamide crystal [Internet]. Applied Organometallic Chemistry. 2020 ; 2020 1-19 art. e5623 : + Supplementary materials ( S1-S9).[citado 2024 ago. 03 ] Available from: https://doi.org/10.1002/aoc.5623
Vancouver
Sumrra SH, Hassan AU, Imran M, Khalid M, Mughal EU, Zafar MN, Tahir MN, Raza MA, Braga AAC. Synthesis, characterization, and biological screening of metal complexes of novel sulfonamide derivatives: experimental and theoretical analysis of sulfonamide crystal [Internet]. Applied Organometallic Chemistry. 2020 ; 2020 1-19 art. e5623 : + Supplementary materials ( S1-S9).[citado 2024 ago. 03 ] Available from: https://doi.org/10.1002/aoc.5623
Artigo de periodico
Efficient synthesis, SC-XRD, and theoretical studies of О-Benzenesulfonylated pyrimidines: role of noncovalent interaction influence in their supramolecular network (2020)
Ali, Arif; Khalid, Muhammad; Rehman, Muhammad Fayyaz ur ; Haq, Sadia; Ali, Arif; Tahir, Muhammad Nawaz; Ashfaq, Muhammad; Rasool, Faiz; Braga, Ataualpa Albert Carmo
Source: ACS Omega. Unidade: IQ
Subjects: COMPOSTOS AROMÁTICOS, COMPOSTOS ORGÂNICOS
A citação é gerada automaticamente e pode não estar totalmente de acordo com as normas
ABNT
ALI, Arif et al. Efficient synthesis, SC-XRD, and theoretical studies of О-Benzenesulfonylated pyrimidines: role of noncovalent interaction influence in their supramolecular network. ACS Omega, v. 5, p. 15115−15128, 2020Tradução . . Disponível em: https://doi.org/10.1021/acsomega.0c00975. Acesso em: 03 ago. 2024.
APA
Ali, A., Khalid, M., Rehman, M. F. ur, Haq, S., Ali, A., Tahir, M. N., et al. (2020). Efficient synthesis, SC-XRD, and theoretical studies of О-Benzenesulfonylated pyrimidines: role of noncovalent interaction influence in their supramolecular network. ACS Omega, 5, 15115−15128. doi:10.1021/acsomega.0c00975
NLM
Ali A, Khalid M, Rehman MF ur, Haq S, Ali A, Tahir MN, Ashfaq M, Rasool F, Braga AAC. Efficient synthesis, SC-XRD, and theoretical studies of О-Benzenesulfonylated pyrimidines: role of noncovalent interaction influence in their supramolecular network [Internet]. ACS Omega. 2020 ; 5 15115−15128.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1021/acsomega.0c00975
Vancouver
Ali A, Khalid M, Rehman MF ur, Haq S, Ali A, Tahir MN, Ashfaq M, Rasool F, Braga AAC. Efficient synthesis, SC-XRD, and theoretical studies of О-Benzenesulfonylated pyrimidines: role of noncovalent interaction influence in their supramolecular network [Internet]. ACS Omega. 2020 ; 5 15115−15128.[citado 2024 ago. 03 ] Available from: https://doi.org/10.1021/acsomega.0c00975

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