Gaushiya A. Shaikh

About

Dr. Gaushiya Shaikh is a researcher specializing in computational materials science, with a focus on metal-ion batteries, metal–air batteries, hydrogen storage, and low-dimensional materials. She has extensive experience in density functional theory (DFT) simulations, investigating the electronic, optical, and electrochemical properties of emerging materials. Her work focuses on fundamental theoretical studies of materials with applications in energy storage and related nanomaterials. She has co-authored numerous publications in high-impact journals and presented her research at national and international conferences.

Employment

• Gujarat University Research Scholar
  2019 - 2025

Education

• Gujarat University Ph.D
  2021 - 2025
• Gujarat University Master of Philosophy
  2019 - 2021
• Gujarat University Master of Science
  2017 - 2019
• Hemchandracharya North Gujarat University Bachelor of science (Physics)
  2014 - 2017

Projects & Funding

Projects & funding information is unavailable.

Publications (13)

• Ab-initio analysis of CrX2 (X = S, Se and Te) monolayers as bifunctional electrocatalysts for oxygen reduction and evolution reaction in nonaqueous lithium–oxygen batteries
  Journal of Colloid and Interface Science 2026 DOI: 10.1016/j.jcis.2025.138775
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• Theoretical assessment of synthetic and sustainable binders on C2BN monolayers for electrodes in Li-ion batteries
  Journal of Energy Storage 2026 DOI: 10.1016/J.EST.2025.119956
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• Exploring the catalytic performance of a GeTe monolayer for nonaqueous Na-O2 batteries: an in silico study
  Journal of Materials Chemistry A 2025 DOI: 10.1039/d5ta03753k
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• Unveiling the electrochemical properties of Au2B/Au2BO2 MBenes for Li- and Na-ion batteries through DFT simulations
  Journal of Energy Storage 2025 DOI: 10.1016/j.est.2025.117146
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• Alkali and transition metals decorated hexagonal boron nitride nanotube in hydrogen storage application
  International Journal of Hydrogen Energy 2024 DOI: 10.1016/j.ijhydene.2024.09.017
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• An ab-initio analysis of the hydrogen storage behaviour of V doped Si2BN nanotube
  International Journal of Hydrogen Energy 2024 DOI: 10.1016/j.ijhydene.2023.10.166
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• Optimizing the quantum capacitance of AsXBr/AsYBr ((X ≠ Y) = S, Se and Te) Janus heterostructures for high-performance supercapacitors
  Materials Chemistry Frontiers 2024 DOI: 10.1039/d4qm00345d
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• Unlocking the potential of Mg-ion batteries: Cu2C MXene anode with ultrahigh storage and energy density with rapid Mg diffusion
  Chemical Engineering Journal 2024 DOI: 10.1016/j.cej.2024.155368
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• An ab-initio study of hydrogen storage performance of Si2BN nanotubes decorated with group 8B transition metals
  International Journal of Hydrogen Energy 2023 DOI: 10.1016/j.ijhydene.2023.03.238
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• Assessing the Suitability of α-SiS Nanosheet as an Anode Material for Multivalent Metal-Ion Batteries
  Energy and Fuels 2023 DOI: 10.1021/acs.energyfuels.3c02280
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