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Arunima Singh
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Metal-organic frameworks functionalized smart textiles for adsorptive removal of hazardous aromatic pollutants from ambient air
HS Jhinjer, A Singh, S Bhattacharya, M Jassal, AK Agrawal
Journal of Hazardous Materials 411, 125056, 2021
332021
MoS 2 and Janus (MoSSe) based 2D van der Waals heterostructures: emerging direct Z-scheme photocatalysts
A Singh, M Jain, S Bhattacharya
Nanoscale Advances 3 (10), 2837-2845, 2021
302021
Optoelectronic properties of chalcogenide perovskites by many-body perturbation theory
M Kumar, A Singh, D Gill, S Bhattacharya
The Journal of Physical Chemistry Letters 12 (22), 5301-5307, 2021
282021
Stability of non-metal dopants to tune the photo-absorption of TiO2 at realistic temperatures and oxygen partial pressures: A hybrid DFT study
P Basera, S Saini, E Arora, A Singh, M Kumar, S Bhattacharya
Scientific reports 9 (1), 11427, 2019
202019
Sublattice mixing in Cs2AgInCl6 for enhanced optical properties from first-principles
M Kumar, M Jain, A Singh, S Bhattacharya
Applied Physics Letters 118 (2), 2021
14*2021
Capturing excitonic and polaronic effects in lead iodide perovskites using many-body perturbation theory
P Basera, A Singh, D Gill, S Bhattacharya
Journal of Materials Chemistry C 9 (47), 17113-17123, 2021
142021
Understanding the role of Sn substitution and Pb-□ in enhancing the optical properties and solar cell efficiency of CH (NH 2) 2 Pb 1− x− y Sn x□ y Br 3
M Jain, A Singh, P Basera, M Kumar, S Bhattacharya
Journal of Materials Chemistry C 8 (30), 10362-10368, 2020
142020
Sublattice mixing in Cs2AgInCl6 for enhanced optical properties from first-principles
M Kumar, M Jain, A Singh, S Bhattacharya
Applied Physics Letters 118 (2), 2021
112021
Elucidating the Role of Temperature and Pressure to the Thermodynamic Stability of Charged Defects in Complex Metal-Hydrides: A Case Study of NaAlH4
E Arora, S Saini, P Basera, M Kumar, A Singh, S Bhattacharya
The Journal of Physical Chemistry C 123 (1), 62-69, 2018
102018
Exploring Exciton and Polaron Dominated Photophysical Phenomena in Ruddlesden–Popper Phases of Ban+1ZrnS3n+1 (n = 1–3) from Many Body …
D Gill, A Singh, M Jain, S Bhattacharya
The Journal of Physical Chemistry Letters 12 (28), 6698-6706, 2021
92021
Importance of Many-Body Dispersion in the Stability of Vacancies and Antisites in Free-Standing Monolayer of MoS2 from First-Principles Approaches
A Singh, P Basera, S Saini, M Kumar, S Bhattacharya
The Journal of Physical Chemistry C 124 (2), 1390-1397, 2019
82019
Regeneration of Catalytic Activity of CuO–Cu2O/In2O3 Nanocomposite towards Electrochemical Reduction of CO2 by UV Light Treatment
P Devi, A Singh, K Malik, A Verma, S Bhattacharya, JP Singh
Journal of The Electrochemical Society 168 (6), 066518, 2021
32021
Ab-initio study on opto-electronic properties of non-metal doped TiO2
P Basera, S Saini, E Arora, A Singh, S Bhattacharya
Materials Today: Proceedings 26, 94-96, 2020
2020
Electronic, magnetic and optical properties of C, N-doped TiO2 anatase: A hybrid density functional study
P Basera, S Saini, E Arora, A Singh, S Bhattacharya
AIP Conference Proceedings 2115 (1), 2019
2019
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Articles 1–14