Browsing by Author "Zafar, Muddassar"
Now showing items 1-2 of 2
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DFT-guided structural modeling of end-group acceptors at Y123 core for sensitizers as high-performance organic solar dyes and NLO responses
Hassan, Abrar U.; Sumrra, Sajjad H.; Zafar, Muddassar; Mohyuddin, Ayesha; Noreen, Sadaf; Güleryüz, Cihat (2023)Context: The organic solar cells (OSCs) are being developed with the goal of improving their photovoltaic capabilities. Here, utilizing computational methods, six new nonfullerene acceptors (NFA) comprising dyes (A1-A6) ... -
On the quest for solar energy harvesters and nonlinear optics: a DFT exploration of A-D-D-A framework with varying sp2 hybridization
Güleryüz, Cihat; Rehman, Muhammad M. U.; Hassan, Abrar U.; Abass, Zainab A.; Mohyuddin, Ayesha; Zafar, Muddassar; Alotaibi, Mohammed T. (Springer, 2025)In response to address the constraints of fullerene analogues, scientists are constantly working on developing low-cost fullerene-free functionalization for nanoscale organic photovoltaics. During the present study, the ...