Waqas M - Search Results

1

Effect of tailoring π-linkers with extended conjugation on the SJ-IC molecule for achieving high V_OC and improved charge mobility towards enhanced photovoltaic applications.

Zubair H, Mahmood RF, Waqas M, Ishtiaq M, Iqbal J, Ibrahim MAA, Sayed SRM, Noor S, Khera RA. Zubair H, et al. Among authors: waqas m. RSC Adv. 2023 Sep 1;13(37):26050-26068. doi: 10.1039/d3ra03317a. eCollection 2023 Aug 29. RSC Adv. 2023. PMID: 37664200 Free PMC article.

2

Theoretical framework for achieving high V _oc in non-fused non-fullerene terthiophene-based end-capped modified derivatives for potential applications in organic photovoltaics.

Waqas M, Hadia NMA, Shawky AM, Mahmood RF, Essid M, Aloui Z, Alatawi NS, Iqbal J, Khera RA. Waqas M, et al. RSC Adv. 2023 Mar 8;13(11):7535-7553. doi: 10.1039/d3ra00038a. eCollection 2023 Mar 1. RSC Adv. 2023. PMID: 36908528 Free PMC article.

3

Quantum Chemical Approach of Hexaammine (NH₃)₆ complexant with alkali and alkaline earth metals for their potential use as NLO materials.

Hameed S, Waqas M, Zahid S, Gul S, Shawky AM, Alatawi NS, Shehzad RA, Bhatti IA, Ayub K, Iqbal J, Khera RA. Hameed S, et al. Among authors: waqas m. J Mol Graph Model. 2023 Sep;123:108505. doi: 10.1016/j.jmgm.2023.108505. Epub 2023 May 11. J Mol Graph Model. 2023. PMID: 37220700

4

Synergistic modification of end groups in Quinoxaline fused core-based acceptor molecule to enhance its photovoltaic characteristics for superior organic solar cells.

Sadiq S, Waqas M, Zahoor A, Mehmood RF, Essid M, Aloui Z, Khera RA, Akram SJ. Sadiq S, et al. Among authors: waqas m. J Mol Graph Model. 2023 Sep;123:108518. doi: 10.1016/j.jmgm.2023.108518. Epub 2023 May 21. J Mol Graph Model. 2023. PMID: 37235903

5

A DFT approach for finding therapeutic potential of graphyne as a nanocarrier in the doxorubicin drug delivery to treat cancer.

Perveen M, Noreen L, Waqas M, Mehmood RF, Iqbal J, Manzoor S, Nazir S, Shawky AM, Khera RA. Perveen M, et al. Among authors: waqas m. J Mol Graph Model. 2023 Nov;124:108537. doi: 10.1016/j.jmgm.2023.108537. Epub 2023 Jun 12. J Mol Graph Model. 2023. PMID: 37321062

6

End-cap modeling on the thienyl-substituted benzodithiophene trimer-based donor molecule for achieving higher photovoltaic performance.

Maqsood MH, Khera RA, Mehmood RF, Akram SJ, Al-Zaqri N, Ibrahim MAA, Noor S, Waqas M. Maqsood MH, et al. Among authors: waqas m. J Mol Graph Model. 2023 Nov;124:108550. doi: 10.1016/j.jmgm.2023.108550. Epub 2023 Jun 13. J Mol Graph Model. 2023. PMID: 37331259

7

A DFT study for improving the photovoltaic performance of organic solar cells by designing symmetric non-fullerene acceptors by quantum chemical modification on pre-existed LC81 molecule.

Zahoor A, Sadiq S, Khera RA, Essid M, Aloui Z, Alatawi NS, Ibrahim MAA, Hasanin THA, Waqas M. Zahoor A, et al. Among authors: waqas m. J Mol Graph Model. 2023 Dec;125:108613. doi: 10.1016/j.jmgm.2023.108613. Epub 2023 Aug 25. J Mol Graph Model. 2023. PMID: 37659133

8

A computational insight into enhancement of photovoltaic properties of non-fullerene acceptors by end-group modulations in the structural framework of INPIC molecule.

Zubair H, Akhter MS, Waqas M, Ishtiaq M, Bhatti IA, Iqbal J, Skawky AM, Khera RA. Zubair H, et al. Among authors: waqas m. J Mol Graph Model. 2024 Jan;126:108664. doi: 10.1016/j.jmgm.2023.108664. Epub 2023 Nov 2. J Mol Graph Model. 2024. PMID: 37948853

9

High-Efficiency and Low-Energy-Loss Organic Solar Cells Enabled by Tuning the End Group Modification of the Terthiophene-Based Acceptor Molecules to Enhance Photovoltaic Properties.

Rehman FU, Hameed S, Khera RA, Shaban M, Essid M, Aloui Z, Al-Saeedi SI, Ibrahim MAA, Waqas M. Rehman FU, et al. Among authors: waqas m. ACS Omega. 2023 Nov 1;8(45):42492-42510. doi: 10.1021/acsomega.3c05176. eCollection 2023 Nov 14. ACS Omega. 2023. PMID: 38024709 Free PMC article.

10

Approach toward Low Energy Loss in Symmetrical Nonfullerene Acceptor Molecules Inspired by Insertion of Different π-Spacers for Developing Efficient Organic Solar Cells.

Rehman FU, Waqas M, Imran M, Ibrahim MAA, Iqbal J, Khera RA, Hadia NMA, Al-Saeedi SI, Shaban M. Rehman FU, et al. Among authors: waqas m. ACS Omega. 2023 Nov 10;8(46):43792-43812. doi: 10.1021/acsomega.3c05665. eCollection 2023 Nov 21. ACS Omega. 2023. PMID: 38027352 Free PMC article.

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