Photovoltaic properties and enhancement in near-infrared light absorption capabilities of acceptor materials for organic solar cell applications: A quantum chemical …

MRSA Janjua - Journal of Physics and Chemistry of Solids, 2022 - Elsevier
More than 22% power conversion efficiency (PCE) of organic solar cells (OSCs) has been
reported with efficient narrow bandgap acceptor materials as the active layers. And end …

How does bridging core modification alter the photovoltaic characteristics of triphenylamine‐based hole transport materials? Theoretical understanding and prediction

MRSA Janjua - Chemistry–A European Journal, 2021 - Wiley Online Library
Perovskite solar cells have gained immense interest from researchers owing to their good
photophysical properties, low‐cost production, and high power conversion efficiencies. Hole …

Quantum chemical approach of donor− π–acceptor based arylborane–arylamine macrocycles with outstanding photovoltaic properties toward high-performance …

S Zahid, A Rasool, M Ans, M Yaseen, J Iqbal - Energy & Fuels, 2021 - ACS Publications
A theoretical quantum chemical investigation of D− π–A conjugated molecules based on
arylborane–arylamine is proposed with the motive of suggesting new organic materials for …

End-capped modification of dithienosilole based small donor molecules for high performance organic solar cells using DFT approach

M Rafiq, M Salim, S Noreen, RA Khera, S Noor… - Journal of molecular …, 2022 - Elsevier
Considering the worth of molecular designing, ADA type four small donor (SM1-SM4)
photoactive materials comprised of DTS core, substituted with push-pull acceptors at …

Efficient designing of triphenylamine-based hole transport materials with outstanding photovoltaic characteristics for organic solar cells

R Hussain, MY Mehboob, MU Khan, M Khalid… - Journal of Materials …, 2021 - Springer
Hole transport materials (HTMs), especially dopant-free hole transport materials, are getting
attention in enhancing the power conversion efficiencies and stabilities of organic solar cells …

Amplifying the photovoltaic properties of azaBODIPY core based small molecules by terminal acceptors modification for high performance organic solar cells: A DFT …

M Salim, M Rafiq, RA Khera, M Arshad, J Iqbal - Solar Energy, 2022 - Elsevier
Molecular engineering of azaBODIPY based molecule was done to construct four novel
small photoactive materials (SM1-SM4) by varying terminal thiophene spaced acceptors for …

Deciphering the role of invited guest bridges in non-fullerene acceptor materials for high performance organic solar cells

MRSA Janjua - Synthetic Metals, 2021 - Elsevier
Fullerene-free acceptor molecules gained great attention of researchers due to their
excellent light harvesting capability and low toxicity rate. Herein, six new molecules have …

Efficient tuning of triphenylamine-based donor materials for high-efficiency organic solar cells

SA Siddique, MBA Siddique, R Hussain, X Liu… - Computational and …, 2020 - Elsevier
Small molecular donors (SMDs) manifest promising photovoltaic performance and rapid
progress in solar cells community. Herein, we investigate high-performance triphenylamine …

Quantum chemical design of D–π–A‐type donor materials for highly efficient, photostable, and vacuum‐processed organic solar cells

MRSA Janjua - Energy Technology, 2021 - Wiley Online Library
Fullerene‐free donor materials are receiving more and more attention from the scientific
community due to their high power conversion efficiencies (PCEs) and large visible‐light …

Impact of symmetry breaking on the performance of non-fullerene acceptors (NFAs) for photo and thermally stable organic solar cells (OSCs): a DFT-based …

MRSA Janjua - Journal of Photochemistry and Photobiology A …, 2023 - Elsevier
Simultaneous enhancement in the fill factor (FF) and power conversion efficiency (PCE) is a
crucial task for the development of photovoltaic (PV) devices. In addition, symmetrical …