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Navjot Kaur

Adsorption chemistry of co-doped graphene nanoribbon and its derivatives towards carbon based gases for gas sensing applications: Quantum DFT investigation
2022 · Deji R., Akarsh Verma, et al. · Materials Science in Semiconductor Processing · 81
Density functional theory study of carbon monoxide adsorption on transition metal doped armchair graphene nanoribbon
2021 · R. Deji, Akarsh Verma, et al. · Materials Today Proceedings · 65
Boron doped graphene as anode material for Mg ion battery: A DFT study
2022 · Mohd Riyaz, Shivangi Garg, et al. · Computational and Theoretical Chemistry · 51
Physiochemical Properties of New Formulations of 1-Ethyl-3-methylimidazolium Bis(trifluoromethylsulfonyl)imide with Tritons
2014 · Shafila Bansal, Navjot Kaur, et al. · Journal of Chemical & Engineering Data · 22
Spin Inversion Phenomenon and Two-State Reactivity Mechanism for Direct Benzene Hydroxylation by V4O10 Cluster
2016 · Navjot Kaur, Indu Kumari, et al. · The Journal of Physical Chemistry A · 20
DFT based study of transition metals (Au,Ag,Pd& Pt) doped graphitic carbon nitride (gCN) monolayer as a CO gas sensor
2022 · Nihal, Rahul Sharma, et al. · Physica Scripta · 17
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DFT based comparative study of pristine gCN and gCN-ZnO composite as a sensor for CO and CO2 gases
2022 · Nihal, Rahul Sharma, et al. · Materials Letters · 14
Carbon-dioxide gas sensor using co-doped graphene nanoribbon: A first principle DFT study
2021 · Deji, Navjot Kaur, et al. · Materials Today Proceedings · 14
First principles investigation on armchair zinc oxide nanoribbons as uric acid sensors
2019 · Paramjot Singh, Deep Kamal Kaur Randhawa, et al. · Journal of Molecular Modeling · 14
Analysis of uric acid adsorption on armchair silicene nanoribbons: a DFT study
2020 · Tarun Tarun, Deep Kamal Kaur Randhawa, et al. · Journal of Molecular Modeling · 12
Conceptual DFT and TDDFT study on electronic structure and reactivity of pure and sulfur doped (CrO3) (n = 1–10) clusters
2020 · Shivangi Garg, Navjot Kaur, et al. · Journal of Molecular Graphics and Modelling · 11
A new insight into transition metal doped graphene nanoribbon for hydrogen sulfide gas adsorption: First principle investigation
2023 · Jyoti R, Deji R, et al. · Surfaces and Interfaces · 10
Properties of Naked Silver Clusters with Up to 100 Atoms as Found with Embedded-Atom and Density-Functional Calculations
2023 · Shivangi Garg, Navjot Kaur, et al. · Molecules · 10
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Time-dependent DFT and experimental study on visible light photocatalysis by metal oxides of Ti, V and Zn after complexing with a conjugated polymer
2018 · Navjot Kaur, Komal Komal, et al. · New Journal of Chemistry · 9
Enantioselective synthesis of sulfoxide using an SBA-15 supported vanadia catalyst: a computational elucidation using a QM/MM approach
2017 · Navjot Kaur, Shuchi Gupta, et al. · Physical Chemistry Chemical Physics · 9
Improved room temperature ethanol vapors sensing using silver nanoparticles decorated graphitic carbon nitride (Ag-gCN) nanocomposite
2023 · Nihal, Rahul Sharma, et al. · Materials Letters · 8
Nucleotide conjugated (ZnO)3 cluster: Interaction and optical characteristics using TDDFT
2018 · Indu Kumari, Navjot Kaur, et al. · Journal of Molecular Graphics and Modelling · 8
Visible‐Light‐Driven CO₂ Reduction Using Imidazole‐Based Metal–Organic Frameworks as Heterogeneous Photocatalysts
2024 · Anupam Jana, Sinthia Saha, et al. · Chemistry - An Asian Journal · 6
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Transition metal (Ni, Pd and Pt)-embedded graphitic carbon nitride (gCN) monolayer as an acetone sensor: a computational and experimental study
2023 · Nihal, Rahul Sharma, et al. · Journal of Materials Science Materials in Electronics · 6
Tailoring gas sensing properties of armchair graphene nanoribbons via transition metal doping: a first-principles investigation on NO, NO2, and NH3 molecules
2024 · Jyoti R, Navjot Kaur, et al. · Physica Scripta · 5
Enhanced Acetone Sensing Based on Group-11 Metal (Cu, Ag, and Au) Nanoparticles Embedded in Graphitic Carbon Nitride (gCN)
2023 · Nihal, Rahul Sharma, et al. · Atoms · 5
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Temperature controlled synthesis and transformation of dinuclear to hexanuclear zinc complexes of a benzothiazole based ligand: Coordination induced fluorescence enhancement and quenching
2022 · Raman Kumar, Navjot Kaur, et al. · Journal of Molecular Structure · 5
Understanding structure-activity relation in VxOy clusters of varied stoichiometry and sizes through conceptual density functional approach
2019 · Navjot Kaur, Shuchi Gupta, et al. · Journal of Molecular Modeling · 5
Ionic liquid-enhanced rGO@Fe₂O₃ nanohybrid-based conducting paper for efficient phenolic pollutant detection in wastewater
2025 · Mohd. Jamshaiya Raza, Navjot Kaur, et al. · International Journal of Environmental & Analytical Chemistry · 4
Synthesis, photochromic properties, and bioactivity of spiropyrans with electron-donating/withdrawing substituents on indoline and [2 H ]-chromene rings
2025 · Abir Kayal, Navjot Kaur, et al. · Organic & Biomolecular Chemistry · 4
Works count: 50
Citation count: 439
H-index: 11
I10-index: 13
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