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Rao Aqil Shehzad
Rao Aqil Shehzad
Department of Chemistry, University of Agriculture, Faisalabad
在 uaf.edu.pk 的电子邮件经过验证
标题
引用次数
引用次数
年份
Designing of benzothiazole based non-fullerene acceptor (NFA) molecules for highly efficient organic solar cells
RA Shehzad, J Iqbal, MU Khan, R Hussain, HMA Javed, A ur Rehman, ...
Computational and Theoretical Chemistry 1181, 112833, 2020
1022020
Theoretical investigation of supramolecular hydrogen-bonded choline chloride-based deep eutectic solvents using density functional theory
Z Naseem, RA Shehzad, A Ihsan, J Iqbal, M Zahid, A Pervaiz, G Sarwari
Chemical Physics Letters 769, 138427, 2021
922021
Benchmark study of the linear and nonlinear optical polarizabilities in proto-type NLO molecule of para-nitroaniline
S Muhammad, RA Shehzad, J Iqbal, AG Al-Sehemi, M Saravanabhavan, ...
Journal of Theoretical and Computational Chemistry 18 (06), 1950030, 2019
852019
Tuning the optoelectronic properties of triphenylamine (TPA) based small molecules by modifying central core for photovoltaic applications
S Zahid, A Rasool, RA Shehzad, IA Bhatti, J Iqbal
Journal of Molecular Modeling 27, 1-14, 2021
652021
Designing of benzodithiophene (BDT) based non-fullerene small molecules with favorable optoelectronic properties for proficient organic solar cells
A Rasool, S Zahid, RA Shehzad, MS Akhter, J Iqbal
Computational and Theoretical Chemistry 1203, 113359, 2021
592021
Designing of benzodithiophene acridine based Donor materials with favorable photovoltaic parameters for efficient organic solar cell
Q ul Ain, RA Shehzad, U Yaqoob, A Sharif, Z Sajid, S Rafiq, S Iqbal, ...
Computational and Theoretical Chemistry 1200, 113238, 2021
582021
Enhanced linear and nonlinear optical response of superhalogen (Al7) doped graphitic carbon nitride (g-C3N4)
RA Shehzad, J Iqbal, K Ayub, F Nawaz, S Muhammad, AR Ayub, S Iqbal
Optik 226, 165923, 2021
552021
Molecular engineering strategy of naphthalimide based small donor molecules for high-performance organic solar cells
N Naeem, T Tahir, M Ans, A Rasool, RA Shehzad, J Iqbal
Computational and Theoretical Chemistry 1204, 113416, 2021
462021
DFT study of superhalogen and superalkali doped graphitic carbon nitride and its non-linear optical properties
AU Khan, RA Khera, N Anjum, RA Shehzad, S Iqbal, K Ayub, J Iqbal
RSC advances 11 (14), 7779-7789, 2021
462021
Dopant free triphenylamine‐based hole transport materials with excellent photovoltaic properties for high‐performance perovskite solar cells
N Naeem, RA Shehzad, M Ans, MS Akhter, J Iqbal
Energy Technology 10 (2), 2100838, 2022
452022
DFT study of superhalogen (AlF4) doped boron nitride for tuning their nonlinear optical properties
AU Khan, S Muhammad, RA Khera, RA Shehzad, K Ayub, J Iqbal
Optik 231, 166464, 2021
412021
Exploring the optoelectronic and third-order nonlinear optical susceptibility of cross-shaped molecules: insights from molecule to material level
RA Shehzad, S Muhammad, J Iqbal, AG Al-Sehemi, M Yaseen, Z Aloui, ...
Journal of Molecular Modeling 27, 1-10, 2021
362021
DFT study of superhalogen-doped borophene with enhanced nonlinear optical properties
M Ishaq, RA Shehzad, M Yaseen, S Iqbal, K Ayub, J Iqbal
Journal of Molecular Modeling 27 (188), 1-11, 2021
302021
Designing benzothiadiazole based highly efficient non-fullerene acceptor molecules for organic solar cells
QQ Afzal, K Jaffar, M Ans, J Rafique, J Iqbal, RA Shehzad, MS Mahr
Polymer 238, 124405, 2022
272022
Super alkali (OLi3) doped boron nitride with enhanced nonlinear optical behavior
A Raza Ayub, R Aqil Shehzad, SS Alarfaji, J Iqbal
Journal of Nonlinear Optical Physics & Materials 29 (01n02), 2050004, 2020
262020
DFT study of OLi3 and MgF3 doped boron nitride with enhanced nonlinear optical behavior
S Shafiq, RA Shehzad, M Yaseen, K Ayub, AR Ayub, J Iqbal, ...
Journal of Molecular Structure 1251, 131934, 2022
242022
Exploring the potential of tetraazaacene derivatives as photovoltaic materials with enhanced photovoltaic parameters
R Fatima, RA Shehzad, A Rasool, M Yaseen, S Iqbal, MJ Saif, J Iqbal
International Journal of Quantum Chemistry 122 (1), e26817, 2022
242022
A DFT approach for finding therapeutic potential of two dimensional (2D) graphitic carbon nitride (GCN) as a drug delivery carrier for curcumin to treat cardiovascular diseases
M Ilyas, AR Ayu, RA Shehzad, MA Khan, M Perveen, S Amin, ...
Journal of Molecular Structure 1257, 132547, 2022
222022
Enhancement in non-linear optical properties of carbon nitride (C2N) by doping superalkali (Li3O): a DFT study
T Ishfaq, RA Khera, S Zahid, U Yaqoob, RA Shehzad, K Ayub, J Iqbal
Computational and Theoretical Chemistry 1211, 113654, 2022
222022
Designing the optoelectronic properties of BODIPY and their photovoltaic applications for high performance of organic solar cells by using computational approach
I Zubair, RA Khera, A Naveed, RA Shehzad, J Iqbal
Materials Science in Semiconductor Processing 148, 106812, 2022
162022
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