First-principles and semi-empirical tight binding calculations were performed to understand the adsorption of oxygen on the surface of two dimensional (2D) and zigzag stanene nano-ribbons. The intrinsic spin-orbit interaction is considered in the Kane-Mele tight binding model. The adsorption of an oxygen atom or molecule on the 2D stanene opens an electronic energy band gap. We investigate the helical edge states and topological phase in the pure zigzag stanene nano-ribbons. The adsorption of oxygen atoms on the zigzag stanene nano-ribbons deforms the helical edge states at the Fermi level which causes topological (non-trivial) to trivial phase transition. The structural stability of the systems is checked by performing Γ-point phonon calcu...
Abstract—Density-functional theory based on first principles is used to investigate oxidation of a s...
Electron paramagnetic resonance (EPR) study of air-physisorbed defective carbon nano-onions evidence...
We determine the optimal conditions to achieve topological superconducting phases having spin-single...
The electronic properties of stanene, the Sn counterpart of graphene, are theoretically studied usin...
Starting from first-principles calculations on pristine stanene and using maximally localized Wannie...
Silicene, a two-dimensional (2D) silicon counterpart of graphene with attractive electronic properti...
The geometric and electronic properties of grain boundary (GB) in two-dimensional (2D) stanene have ...
The topology of the electron wavefunctions in certain band insulators can give rise to novel topolog...
Combined scanning tunneling microscopy (STM) and density functional theory (DFT) characterizations o...
Recently, two-dimensional buckled honeycomb stanene has been manufactured by molecular beam epitaxy ...
Recently, two-dimensional buckled honeycomb stanene has been fabricated by molecular beam epitaxy gr...
This dissertation presents scanning tunneling microscopy and spectroscopy studies of individual mole...
Ab initio methods are used to study the spin-resolved transport properties of graphene nanoribbons (...
We study the binding of molecular oxygen to a graphene sheet and to a (8,0) single walled carbon nan...
Topological insulators are an emerging class of materials that host highly robust in-gap surface or ...
Abstract—Density-functional theory based on first principles is used to investigate oxidation of a s...
Electron paramagnetic resonance (EPR) study of air-physisorbed defective carbon nano-onions evidence...
We determine the optimal conditions to achieve topological superconducting phases having spin-single...
The electronic properties of stanene, the Sn counterpart of graphene, are theoretically studied usin...
Starting from first-principles calculations on pristine stanene and using maximally localized Wannie...
Silicene, a two-dimensional (2D) silicon counterpart of graphene with attractive electronic properti...
The geometric and electronic properties of grain boundary (GB) in two-dimensional (2D) stanene have ...
The topology of the electron wavefunctions in certain band insulators can give rise to novel topolog...
Combined scanning tunneling microscopy (STM) and density functional theory (DFT) characterizations o...
Recently, two-dimensional buckled honeycomb stanene has been manufactured by molecular beam epitaxy ...
Recently, two-dimensional buckled honeycomb stanene has been fabricated by molecular beam epitaxy gr...
This dissertation presents scanning tunneling microscopy and spectroscopy studies of individual mole...
Ab initio methods are used to study the spin-resolved transport properties of graphene nanoribbons (...
We study the binding of molecular oxygen to a graphene sheet and to a (8,0) single walled carbon nan...
Topological insulators are an emerging class of materials that host highly robust in-gap surface or ...
Abstract—Density-functional theory based on first principles is used to investigate oxidation of a s...
Electron paramagnetic resonance (EPR) study of air-physisorbed defective carbon nano-onions evidence...
We determine the optimal conditions to achieve topological superconducting phases having spin-single...