PP
Poonam Parkar
National University of Ireland, Maynooth, Indian Institute of Technology Bombay
Research areas: Materials Science · Materials Chemistry · Hydrogen Storage and Materials · Boron and Carbon Nanomaterials Research · Fullerene Chemistry and Applications
0009-0003-7534-2048
Employment
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National University of Ireland, Maynooth Postdoctoral Fellow2026 - Present
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Indian Institute of Technology Bombay Postdoctoral Fellow2025 - 2026
Education
Education history is unavailable.
Projects & Funding
Projects & funding information is unavailable.
Publications (22)
- Inorganic, organic and hybrid nanocages with alkali metal and transition metal co-decoration for hydrogen storage: A density functional theory study Save
- Hydrogen Storage Properties of Vanadium‐Decorated Holey Graphyne: A Density Functional Theory Study Save
- Navigating Compositional Space in Palladium Hydride: Benchmarking Machine Learning Interatomic Potentials Save
- Enhancing Hydrogen Storage in Carbon‐Substituted Beryllium Nitride: A <scp>DFT</scp> ‐Based Investigation Save
- Synergistic codoping: Unlocking enhanced hydrogen storage via metal atom engineering – A DFT perspective Save
- Exploring hydrogen storage efficiency in Mg-substituted BeN4: Insights from density functional theory study Save
- Unveiling the HER potential of TM-substituted PdTe 2 monolayers: a first-principles study Save
- On-the-Fly Machine Learning Interatomic Potential for Bulk PdH: Assessing Accuracy and Efficiency Save
- Unlocking hydrogen storage potential of carbon nanocluster: a computational study of metal codoping effects Save
- Computational insights into Li cluster–based gas sensors Save
- LiLi and LiTi codecorated C12X8 (X = B, C, P, Si, and As) nanocages for hydrogen storage: A DFT study Save
- Reactivity of B12N12 nanocage toward nitrosyl halides: Adsorption of NOF, NOCl, and NOBr using DFT framework Save
- Ti functionalized cycloparaphenylene and its derivatives for hydrogen storage: A density functional theory approach Save
- Li-doped C20 nanocage and its derivatives for gas sensing application: A density functional theory study Save
- Metal-cluster (Be, Sc, Ti) decorated C24 nanocages and their hydrogen storage performance Save
- SO2 sensing performance of silicon substitutional doped (8,0) carbon nanotube: A density functional theory study Save
- Metal-decorated BCN nanocages for efficient hydrogen storage: A computational analysis Save
- Be/Li doped C24 and C12B12 nanocages for hydrogen storage: A comparison Save
- Scandium Substituted Adamantane, Si Adamantane, Ge Adamantane Cages and Their Derivatives for Hydrogen Storage: A DFT Analysis Save
- Ti doped [1,1,1,1] paracyclophane and its derivatives for hydrogen storage: A Computational Insight Save