Publications
You can also find my articles on my Google Scholar profile.
- "Electron-phonon vertex correction effect in superconducting H₃S"[npj Comput. Mater.] (2025)
- "Cubic BeB₂: A metastable p-type conductive material from first principles"[Phys. Rev. B 112, 155206] (2025)
- "Phonon-limited carrier transport in the Weyl semimetal TaAs"[Phys. Rev. B 112, 104311] (2025)
- "Electrostatic Self-assembly Driven Heterojunction of CeO₂/g-C₃N₄ Nanosheets for Efficient Photocatalytic Hydrogen Evolution"
- "Inverse Faraday effect in 3d, 4d, and 5d transition metals"[Phys. Rev. B 111, 174413] (2025)
- "Nonadiabatic and anharmonic effects in high-pressure H₃S and D₃S superconductors"[arXiv:2510.25902] (2025)
- "Defects Dynamics in Photo‐Excited CeO₂ and their Influence on CO₂ Photoreduction"[Adv. Funct. Mater. e13933] (2025)
- "Phonon-limited carrier transport in the Weyl semimetal TaAs"[arXiv:2505.16544] (2025)
- "Stability-superconductivity map for compressed Na-intercalated graphite"[Phys. Rev. B 110, 174508] (2024)
- "Hydrothermally Grown Halogen-Doped ZnO Nanorods for Photoelectrochemical Water Oxidation: Experimental and DFT Insights"
- "Si₂BN nanosheets as anchoring cathode material for realizing high capacity Al-ion battery"
- "Transient Ellipsometry Measurements of the Specular Inverse Faraday Effect in Transition Metals"
- "Spin contribution to the inverse Faraday effect of nonmagnetic metals"[Phys. Rev. B 107, 214432] (2023)
- "Design of Aluminium ion battery with Graphyne host: Lowest volume expansion, High stability, and Low diffusion barriers"
- "Work Function of van der Waals Topological Semimetals: Experiment and Theory"
- "High energy ion induced modification in TiO₂ nanorods: thermal spike driven crystallinity, morphology and electronic structure transformation"[Nanoscale Adv. 4, 241-249] (2022)
- "Adsorption and Degradation Mechanism of 2,4,6-TNT on TiO₂ (110) surface"[Surf. Sci. 713, 171902] (2021)
- "Graphdiyne-A promising Cathode Material for Aluminium dual ion Battery"
- "Electronic Structure of Graphene/TiO₂ Interface: Design and Functional Perspectives"
- "Development of Short and Long-range Magnetic order in the Double Perovskite-based Frustrated Triangular Lattice Antiferromagnet Ba₂MnTeO₆"[Sci. Rep. 11, 6959] (2021)
- "Density Functional Theory Studies of Si₂BN Nanosheets as Anode Materials for Magnesium Ion Batteries"
- "Fluorine Intercalated Graphene: Formation of a Two-dimensional Spin Lattice through Pseudoatomization"
- "Mechanistic Understanding of NO₂ Dissociation on a Rutile TiO₂(110) Surface: An Electronic Structure Study"[J. Phys. Chem. C 124, 8786] (2020)
- "Facet Dependent Catalytic Activities of Anatase TiO₂ for CO₂ Adsorption and Conversion"
- "Quantum-Mechanical Process of Carbonate Complex Formation and Large-scale Anisotropy in the Adsorption Energy of CO₂ on Anatase TiO₂(001) Surface"
- "Quantum well Structure of Double Perovskite Superlattice and Formation of Spin-polarized Two-dimensional Electron gas"[Phys. Rev. B 98, 115155] (2018)
- "Virtual synthesis of crystals using ab initio MD: Case study on LiFePO4"
