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19922026
most citedProbing magnetism in 2D van der Waals crystalline insulators via electron tunneling

940 citations

Showing 2021 · cond-mat.mtrl-sciShow all

7 papers · 2 filters

cond-mat.mtrl-sci2021★ 27 cited

Effect of substitutional doping and disorder on the phase stability, magnetism, and half-metallicity of Heusler alloys

Nikolai A Zarkevich, Prashant Singh, A. V. Smirnov +1

Spintronics is the fast growing field that will play a key role in optimizing power consumption, memory, and processing capabilities of nanoelectronic devices. Heusler alloys are p…

cond-mat.mtrl-sci2021★ 155 cited

Towards Stacking Fault Energy Engineering in FCC High Entropy Alloys

Tasneem Khan, Tanner Kirk, Guillermo Vazquez +5

Stacking Fault Energy (SFE) is an intrinsic alloy property that governs much of the plastic deformation mechanisms observed in fcc alloys. While SFE has been recognized for many ye…

cond-mat.mtrl-sci2021★ 19 cited

Pseudoelastic deformation in Mo-based refractory multi-principal element alloys

Aayush Sharma, Prashant Singh, Tanner Kirk +5

Phase diagrams supported by density functional theory methods can be crucial for designing high-entropy alloys that are subset of multi-principalelement alloys. We present phase…

cond-mat.mtrl-sci2021★ 19 cited

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…

cond-mat.mtrl-sci2021★ 11 cited

Designing order-disorder transformation in high-entropy ferritic steels

Singh, Prashant, Johnson +1

Order-disorder transformations hold an essential place in chemically complex high-entropy ferritic-steels (HEFSs) due to their critical technological application. The chemical inho…

cond-mat.mtrl-sci2021★ 34 cited

On the martensitic transformation in FeMnCoCr high-entropy alloy

Prashant Singh, Sezer Picak, Aayush Sharma +4

High-entropy alloys (HEAs), and even medium-entropy alloys (MEAs), are an intriguing class of materials in that structure and property relations can be controlled via alloying and…

cond-mat.mtrl-sci2021★ 7 cited

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 (…