1 citations · 1 across the 4 of their papers we have counts for
15 papers
Physically motivated iso-orbital indicator for meta-GGA exchange functionals
Jeet Sharma, Abhishek Bhattacharjee, Bikash Patra +1
The iso-orbital indicator is a key ingredient of meta-generalized gradient approximation (meta-GGA) functionals, but diverges in low-dens…
Symmetry-Engineered Nonlinear Hall Response and Optical Response in Strained Monolayer Janus AsTeBr
Dimple Rani, Ritesh Ranjan Badhai, Gayatri Panda +2
The nonlinear Hall effect (NLHE) enables the generation of a transverse charge current in nonmagnetic materials with broken inversion symmetry while preserving time-reversal symmet…
A Unified Dielectric-Dependent Hybrid Functional for Accurate Band Gaps across Dimensions
Subrata Jana, Manoar Hossain, Arghya Ghosh +3
Predicting fundamental band gaps across material classes and dimensionalities remains a central challenge in electronic-structure theory. Here, we show that intrinsic dielectric sc…
Nonlocal Orbital-Free Kinetic Energy Functional from the Jellium-with-Gap Model for Finite Systems
Abhishek Bhattacharjee, Subrata Jana, Szymon Smiga +1
The quasi-linear scaling of orbital-free density functional theory (OF-DFT) with system size makes it a computationally efficient alternative to conventional Kohn--Sham density fun…
Frontier Orbital Engineering in Heteroatom-Doped Prototypical Organic Dyes for Dye-Sensitized Solar Cells
Aditi Singh, Ram Dhari Pandey, Subrata Jana +3
The computational design of heteroatom-doped organic dyes for dye-sensitized solar cells (DSSCs) remains challenging, as predictive methods must accurately describe long-range char…
Supercurrent spin Hall effect enabled nanopillar Josephson diodes
Debashree Nayak, Dimple Rani, Prasanjit Samal +1
In the recent years it has been possible to achieve diode-like, non-reciprocal current-voltage response in Josephson junctions, despite the intrinsic symmetry of the Josephson effe…