Irfan A - Search Results

1

The impact of position and number of methoxy group(s) to tune the nonlinear optical properties of chalcone derivatives: a dual substitution strategy.

Muhammad S, Al-Sehemi AG, Irfan A, Chaudhry AR, Gharni H, AlFaify S, Shkir M, Asiri AM. Muhammad S, et al. Among authors: irfan a. J Mol Model. 2016 Apr;22(4):73. doi: 10.1007/s00894-016-2946-8. Epub 2016 Mar 12. J Mol Model. 2016. PMID: 26969679

2

Donor-enhanced bridge effect on the electronic properties of triphenylamine based dyes: density functional theory investigations.

Irfan A, Al-Sehemi AG, Asiri AM. Irfan A, et al. J Mol Model. 2012 Aug;18(8):3609-15. doi: 10.1007/s00894-012-1372-9. Epub 2012 Feb 17. J Mol Model. 2012. PMID: 22350297

3

Synthesis, characterization and DFT study of methoxybenzylidene containing chromophores for DSSC materials.

Al-Sehemi AG, Irfan A, Asiri AM, Ammar YA. Al-Sehemi AG, et al. Among authors: irfan a. Spectrochim Acta A Mol Biomol Spectrosc. 2012 Jun;91:239-43. doi: 10.1016/j.saa.2012.01.016. Epub 2012 Jan 21. Spectrochim Acta A Mol Biomol Spectrosc. 2012. PMID: 22381797

4

Quantum chemical investigations aimed at modeling highly efficient zinc porphyrin dye sensitized solar cells.

Irfan A, Hina N, Al-Sehemi AG, Asiri AM. Irfan A, et al. J Mol Model. 2012 Sep;18(9):4199-207. doi: 10.1007/s00894-012-1421-4. Epub 2012 May 4. J Mol Model. 2012. PMID: 22552753

5

Quantum chemical study in the direction to design efficient donor-bridge-acceptor triphenylamine sensitizers with improved electron injection.

Irfan A, Al-Sehemi AG. Irfan A, et al. J Mol Model. 2012 Nov;18(11):4893-900. doi: 10.1007/s00894-012-1488-y. Epub 2012 Jun 21. J Mol Model. 2012. PMID: 22718326

6

Quantum chemical study of the donor-bridge-acceptor triphenylamine based sensitizers.

Irfan A, Jin R, Al-Sehemi AG, Asiri AM. Irfan A, et al. Spectrochim Acta A Mol Biomol Spectrosc. 2013 Jun;110:60-6. doi: 10.1016/j.saa.2013.02.045. Epub 2013 Mar 6. Spectrochim Acta A Mol Biomol Spectrosc. 2013. PMID: 23557773

7

Synthesis, characterization and density functional theory investigations of the electronic, photophysical and charge transfer properties of donor-bridge-acceptor triaminopyrazolo[1,5-a]pyrimidine dyes.

Al-Sehemi AG, Irfan A, Fouda AM. Al-Sehemi AG, et al. Among authors: irfan a. Spectrochim Acta A Mol Biomol Spectrosc. 2013 Jul;111:223-9. doi: 10.1016/j.saa.2013.04.010. Epub 2013 Apr 10. Spectrochim Acta A Mol Biomol Spectrosc. 2013. PMID: 23648968

8

Modeling of multifunctional donor-bridge-acceptor 4,6-di(thiophen-2-yl)pyrimidine derivatives: a first principles study.

Irfan A, Al-Sehemi AG, Al-Assiri MS. Irfan A, et al. J Mol Graph Model. 2013 Jul;44:168-76. doi: 10.1016/j.jmgm.2013.06.003. Epub 2013 Jun 19. J Mol Graph Model. 2013. PMID: 23835610

9

A dual approach to study the electro-optical properties of a noncentrosymmetric L-asparagine monohydrate.

Shkir M, Muhammad S, AlFaify S, Irfan A, Yahia IS. Shkir M, et al. Among authors: irfan a. Spectrochim Acta A Mol Biomol Spectrosc. 2015 Feb 25;137:432-41. doi: 10.1016/j.saa.2014.08.033. Epub 2014 Aug 30. Spectrochim Acta A Mol Biomol Spectrosc. 2015. PMID: 25238181

10

How does hybrid bridging core modification enhance the nonlinear optical properties in donor-π-acceptor configuration? A case study of dinitrophenol derivatives.

Muhammad S, Irfan A, Shkir M, Chaudhry AR, Kalam A, AlFaify S, Al-Sehemi AG, Al-Salami AE, Yahia IS, Xu HL, Su ZM. Muhammad S, et al. Among authors: irfan a. J Comput Chem. 2015 Jan 15;36(2):118-28. doi: 10.1002/jcc.23777. Epub 2014 Nov 10. J Comput Chem. 2015. PMID: 25382405

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