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Ab-initio investigation of the interfacial structural, electronic, and magnetic properties of CoMnAl/X (X = MgO and GaAs) heterostructures
Amar Kumar, Mitali, Sujeet Chaudhary +1
The structural, electronic, and magnetic properties of (100)-oriented CoMnAl/MgO and CoMnAl/GaAs heterostructures are investigated using plane-wave pseudopotential dens…
Surface properties of CoMnAl Heusler alloy
Amar Kumar, Sujeet Chaudhary, Sharat Chandra
Using the plane-wave pseudopotential method within the framework of density functional theory, CoMnAl (100), (110), and (111) surfaces with different atomic terminations have b…
Effect of the Lattice-distortion on the Electronic Structure, Magnetic Anisotropy, and Hall Conductivities of the CoFeCrGa Spin Gapless Semiconductor: A First-Principles Study
Amar Kumar, Sujeet Chaudhary, Sharat Chandra
Spin gapless semiconductors (SGSs), novel quantum materials, are notable for their tunable spin-transport properties. Considering that the SGS materials might have an invariably de…
Iron phosphate glass structure at different length scale with emphasis on the medium range: a classical molecular dynamic study
Shakti Singh, Manan Dholakia, Sharat Chandra
Glasses are known to have medium range order (MRO) but its link to any experimentally measurable quantity is still ambiguous. The first sharp diffraction peak (FSDP) in structure-f…
Electrochemical supercapacitor performance of SnO2 quantum dots
V. Bonu, B. Gupta, S. Chandra +3
Metal oxide nanostructures are widely used in energy applications like super capacitors and Li-on battery. Smaller size nanocrystals show better stability, low ion diffusion time,…