Zunaira Shafiq

Government College University, Faisalabad — Pakistan

Engineering · Physical Sciences

8h-index400citations26works19.62yr avg
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Research Topics

Organic Electronics and Photovoltaics(10), Conducting polymers and applications(9), Machine Learning in Materials Science(6), Fullerene Chemistry and Applications(4), Nanoparticles: synthesis and applications(3)

Publications26 total

Machine learning assisted designing of small molecule acceptors with multiple terminal electron-deficient groups and performance prediction for next-generation photovoltaics
Journal of Solid State Chemistry·2025· 2 citedOpen Access
Author response for "A review on green synthesis of silver nanoparticles (SNPs) using plant extracts: a multifaceted approach in photocatalysis, environmental remediation, and biomedicine"
2025
Author response for "A review on green synthesis of silver nanoparticles (SNPs) using plant extracts: a multifaceted approach in photocatalysis, environmental remediation, and biomedicine"
2025
Unveiling next-generation organic photovoltaics: Quantum mechanical insights into non-fullerene donor–acceptor compounds
Spectrochimica Acta Part A Molecular and Biomolecular Spectroscopy·2025· 7 cited
A review on green synthesis of silver nanoparticles (SNPs) using plant extracts: a multifaceted approach in photocatalysis, environmental remediation, and biomedicine
RSC Advances·2025· 179 citedOpen Access
Advances in Quantum Dot Solar Cells: Materials Innovation, Device Engineering, and Performance Evolution
International Science and Technology Journal·2025
Data driven design of dyes with high dielectric constant for efficient optoelectronics
Journal of Solid State Chemistry·2024· 3 cited
Quantum chemical modelling of non-fullerene donor and acceptor compounds for high performance organic photovoltaics and optoelectronics
Journal of Solid State Chemistry·2024· 7 cited
A Review on Fabrication and Quantum Chemical Designing of Organic Solar Cells: Role of DFT and Machine Learning Technologies
High Energy Chemistry·2024· 3 cited
Design of organic electronic materials with lower exciton binding energy: machine learning analysis and high-throughput screening
Optical and Quantum Electronics·2024· 4 cited
Recent Developments and Future Challenges for Perovskite Solar Cells: Physical Insights to Improve PCE
Brazilian Journal of Physics·2024· 8 cited
Chemical similarity-based design of materials for organic solar cells: Visualizing the generated chemical space of polymers
Materials Today Communications·2024· 39 cited
The role of political hate speech in promoting extreme ideologies and manipulating public discourse for social approval in Pakistan
International Social Science Journal·2024· 3 citedOpen Access
Author response for "The role of political hate speech in promoting extreme ideologies and manipulating public discourse for social approval in Pakistan"
2023
Heavy metal toxicity arising from the industrial effluents repercussions on oxidative stress, liver enzymes and antioxidant activity in brain homogenates of Oreochromis niloticus
Scientific Reports·2023· 32 citedOpen Access
An efficient framework to design near-IR monomers for polymer solar cells with the help of machine learning, virtual screening and chemical space visualization
Journal of Photochemistry and Photobiology A Chemistry·2023· 5 cited
Author response for "The role of political hate speech in promoting extreme ideologies and manipulating public discourse for social approval in Pakistan"
2023
Tuning nonlinear optical properties of tetracyclopentatetraphenylnene by superhalogens doping: Quantum chemical perspective of novel NLO materials for modern optoelectronic applications
Materials Science and Engineering B·2023· 13 cited
Designing of symmetric and asymmetric small molecule acceptors for organic solar cells: A farmwork based on Machine learning, virtual screening and structural analysis
Journal of Photochemistry and Photobiology A Chemistry·2023· 29 cited
RETRACTED:Exploring the intermolecular interactions in carbon disulfide dimer: An ab initio study using an improved Lennard–Jones potential energy surface for physical insights
Journal of Physical Organic Chemistry·2023
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Frequent Co-authors

Muhammad Ramzan Saeed Ashraf Janjua(19), Sehar Shahzadi(5), Nimra Sultan(4), Nadia Akram(4), Sehrish Fatima(3), Qurat Ul Ain(3), Muhammad Usman Khan(3), Norah Alhokbany(3), Saba Jamil(3), Muhammad Rafi(3), Hosam O. Elansary(2), Tayyaba Mubashir(2), Mudassir Hussain Tahir(2), Junaid Yaqoob(2), Khalid Mahmood Zia(2), Mudassir Hussain Tahir(2), Muhammad Usman Hafeez(1), Maha Ikram(1), Azza Sarfraz(1), Zouina Sarfraz(1)