1 citations · 1 across the 11 of their papers we have counts for
11 papers
Multi-site mixing and entropy stabilization of CsPbI with potential application in photovoltaics
Namitha Anna Koshi, Krishnamohan Thekkepat, Doh-Kwon Lee +2
Metal halide perovskite solar cells have achieved dramatic improvements in their power conversion efficiency in the recent past. Since compositional engineering plays an important…
Integrating Density Functional Theory with Deep Neural Networks for Accurate Voltage Prediction in Alkali-Metal-Ion Battery Materials
Sk Mujaffar Hossain, Namitha Anna Koshi, Seung-Cheol Lee +2
Accurate prediction of the voltage of battery materials plays a pivotal role in the advancement of energy storage technologies and the rational design of high-performance cathode m…
Tuning the Electronic and Magnetic Properties of Double Transition Metal MCrCT (M = Ti, Mo) Janus MXenes for Enhanced Spintronics and Nanoelectronics
Swetarekha Ram, Namitha Anna Koshi, Seung-Cheol Lee +1
Janus MXenes, a new category of two-dimensional (2D) materials, shows promising potential for advances in optoelectronics, spintronics and nanoelectronics. Our theoretical investig…
Customizing PBE Exchange-Correlation functionals: A comprehensive approach for band gap prediction in diverse semiconductors
Satadeep Bhattacharjee, Namitha Anna Koshi, Seung-Cheol Lee
Accurate band gap prediction in semiconductors is crucial for materials science and semiconductor technology advancements. This paper extends the Perdew-Burke-Ernzerhof (PBE) funct…
Straintronics using the monolayer-Xene platform -- a comparative study
Swastik Sahoo, Namitha Anna Koshi, Seung-Cheol Lee +2
Monolayer silicene is a front runner in the 2D-Xene family, which also comprises germanene, stanene, and phosphorene, to name a few, due to its compatibility with current silicon f…
Iridium-doping as a strategy to realize visible light absorption and p-type behavior in BaTiO3
Sujana Chandrappa, Simon Joyson Galbao, P S Sankara Rama Krishnan +8
BaTiO3 is typically a strong n-type material with tuneable optoelectronic properties via doping and controlling the synthesis conditions. It has a wide band gap that can only harne…
High-frequency complex impedance analysis of the two-dimensional semiconducting MXene-
Anup Kumar Mandia, Rohit Kumar, Namitha Anna Koshi +3
The two-dimensional compound group of MXenes, which exhibit unique optical, electrical, chemical, and mechanical properties, are an exceptional class of transition metal carbides a…
Can magneto-transport properties provide insight into the functional groups in semiconducting MXenes?
Namitha Anna Koshi, Anup Kumar Mandia, Bhaskaran Muralidharan +2
The Hall scattering factor of Sc2CF2, Sc2CO2 and Sc2C(OH)2 is calculated using Rode's iterative approach by solving the Boltzmann transport equation. This is carried out in conjunc…
Electrical and magneto transport in 2D semiconducting MXene Ti2CO2
Anup Kumar Mandia, Namitha Anna Koshi, Bhaskaran Muralidharan +2
The Hall scattering factor is formulated using Rode's iterative approach to solving the Boltzmann transport equation in such a way that it may be easily computed within the scope o…
Silicene for flexible electronics
Swastik Sahoo, Abhinaba Sinha, Namitha Anna Koshi +3
The outstanding properties of graphene have laid the foundation for exploring graphene-like two-dimensional systems, commonly referred to as 2D-Xenes. Amongst them, silicene is a f…
Probing Photo-excited Charge Carrier Trapping and Defect Formation in Synergistic Doping of SrTiO3
Namitha Anna Koshi, Dharmapura H K Murthy, Sudip Chakraborty +2
Strontium titanate (SrTiO3) is widely used as a promising photocatalyst due to its unique band edge alignment with respect to the oxidation and reduction potential corresponding to…