110 citations · 170 across the 14 of their papers we have counts for
14 papers
Effect of heterostructure engineering on electronic structure and transport properties of two-dimensional halide perovskites
Rahul Singh, Prashant Singh, Ganesh Balasubramania
Organic-inorganic halide perovskite solar cells have attracted much attention due to their low-cost fabrication, flexibility, and high-power conversion efficiency. More recent effo…
Neural-networks model for force prediction in multi-principal-element alloys
Rahul Singh, Prashant Singh, Aayush Sharma +6
Atomistic simulations can provide useful insights into the physical properties of multi-principal-element alloys. However, classical potentials mostly fail to capture key quantum (…
Accelerating computational modeling and design of high-entropy alloys
Rahul Singh, Aayush Sharma, Prashant Singh +2
With huge design spaces for unique chemical and mechanical properties, we remove a roadblock to computational design of {high-entropy alloys} using a metaheuristic hybrid Cuckoo Se…
Giant longitudinal negative magneto-resistance under perpendicular magnetic field in BiFeSeS Topological insulators
Rahul Singh, Vinod K. Gangwar, Abhishek Singh +5
The magnetic, magneto-transport and ARPES studies of Fe and S co-doped Bi2Se3 were investigated. With doping concentration magneto-resistance (MR) gradually decreases and for a cer…
Room temperature large spontaneous exchange bias in hard-soft antiferromagnetic composite BiFeO3-TbMnO3
Prince Kr. Gupta, Surajit Ghosh, Shiv Kumar +12
We report the presence of giant spontaneous exchange bias (HSEB) in a hard and soft antiferromagnetic composite of BiFeO3-TbMnO3 (BFO-TMO in 7:3 and 8:2 ratio). The HSEB varies bet…
3D Deep Learning with voxelized atomic configurations for modeling atomistic potentials in complex solid-solution alloys
Rahul Singh, Aayush Sharma, Onur Rauf Bingol +4
The need for advanced materials has led to the development of complex, multi-component alloys or solid-solution alloys. These materials have shown exceptional properties like stren…