Aurab Chakrabarty

Defect-trapped electrons and ferromagnetic exchange in ZnO

Aurab Chakrabarty, Charles H. Patterson · Physical Review B · 2011 · 51 citations

Materials Science, Spintronics, Magnetism +15

Soft MAX phases with boron substitution: A computational prediction

Poulami Chakraborty, Aurab Chakrabarty, Amlan Dutta et al. · Physical Review Materials · 2018 · 32 citations

Engineering, Severe Plastic Deformation, Cubic Boron Nitride +20

Transition levels of defects in ZnO: Total energy and Janak's theorem methods

Aurab Chakrabarty, Charles H. Patterson · The Journal of Chemical Physics · 2012 · 24 citations · Full text

Total Energy, Engineering, Defect Tolerance +17

Carbon adsorption on and diffusion through the Fe(110) surface and in bulk: Developing a new strategy for the use of empirical potentials in complex material set‐ups

Iwan Halim Sahputra, Aurab Chakrabarty, Óscar A. Restrepo et al. · physica status solidi (b) · 2016 · 19 citations · Full text

Engineering, Empirical Force Field, Material Simulation +18

Benchmarking the performance of plane-wave vs. localized orbital basis set methods in DFT modeling of metal surface: a case study for Fe-(110)

Kapil Adhikari, Aurab Chakrabarty, O. Bouhali et al. · Journal of Computational Science · 2018 · 18 citations

Materials Science, Surface Characterization, Engineering +14