Browsing by Author Luhadiya, Nitin

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Showing results 1 to 11 of 11
Issue DateTitleAuthor(s)
2022Adsorption and desorption behavior of titanium-decorated polycrystalline graphene toward hydrogen storage: a molecular dynamics studyLuhadiya, Nitin; Kundalwal, Shailesh; Sahu, Santosh Kumar
2023Atomistic insights into the H2 adsorption and desorption behavior of novel Li-functionalized polycrystalline CNTsMishra, Saurabh; Luhadiya, Nitin; Kundalwal, Shailesh
2025Development and evaluation of machine-learned interatomic potentials for carbon nanotubes for molecular dynamics simulationsMishra, Saurabh; Luhadiya, Nitin; Kundalwal, Shailesh
2020Effect of carbon doping on electromechanical response of boron nitride nanosheetsKundalwal, Shailesh; Choyal, Vijay K.; Luhadiya, Nitin; Choyal, Vijay K.
2021Enhancement of piezoelectric and flexoelectric response of boron nitride sheet superlattices via interface and defect engineeringKundalwal, Shailesh; Choyal, Vijay K.; Choyal, Vijay K.; Nevhal, Subhash K.; Luhadiya, Nitin
2024Enhancing piezoelectric performance of CNTs through B and N substitution under combined mechanical loads: insights from MD simulationsLuhadiya, Nitin; Kundalwal, Shailesh
2021Investigation of hydrogen adsorption behavior of graphene under varied conditions using a novel energy-centered methodLuhadiya, Nitin; Kundalwal, Shailesh; Sahu, Santosh Kumar
2023Investigation of unified impact of Ti adatom and N doping on hydrogen gas adsorption capabilities of defected graphene sheetsLuhadiya, Nitin; Kundalwal, Shailesh; Sahu, Santosh Kumar
2021Strain and defect engineering of graphene for hydrogen storage via atomistic modellingKag, Deepak; Luhadiya, Nitin; Kundalwal, Shailesh
2024-03-22Unraveling the potential of graphene for hydrogen storage: insights from molecular dynamics simulationsKundalwal, Shailesh I.; Sahu, Santosh Kumar; Luhadiya, Nitin
2025Unravelling piezoelectric properties of novel C3N and C3B nanotubes: The first of its kind atomistic investigationSen, Dilip; Luhadiya, Nitin; Kundalwal, Shailesh