Related papers: Efficient Linear Scaling Approach for Computing th…
We have developed an efficient order-N real-space Kubo approach for the calculation of the phonon conductivity which outperforms state-of-the-art alternative implementations based on the Green's function formalism. The method treats…
A Kubo inspired formalism is proposed to compute the longitudinal and transverse dynamical conductivities of an electron in a plane (or a gas of electrons at zero temperature) coupled to the potential vector of an external local magnetic…
An efficient order$-N$ real-space Kubo approach is developed for the calculation of the thermal conductivity of complex disordered materials. The method, which is based on the Chebyshev polynomial expansion of the time evolution operator…
We describe an efficient numerical approach to calculate the longitudinal and transverse Kubo conductivities of large systems using Bastin's formulation. We expand the Green's functions in terms of Chebyshev polynomials and compute the…
The Hall conductivity given by the Kubo formula is a linear response of the quantum transverse transport to a weak electric field. It has been intensively studied for a quantum system without decoherence, but it is barely explored for…
In recent years, predictive computational modeling has become a cornerstone for the study of fundamental electronic, optical, and thermal properties in complex forms of condensed matter, including Dirac and topological materials. The…
We use the Kubo-Landauer formalism to compute the longitudinal (two-terminal) conductance of a two dimensional electron system placed in a strong perpendicular magnetic field, and subjected to periodic modulations and/or disorder…
We study how the intrinsic anomalous Hall conductivity is modified in two-dimensional crystals with broken time-reversal symmetry due to weak inhomogeneity of the applied electric field. Focusing on a clean noninteracting two-band system…
Charge carrier transport in single-layer graphene with one-dimensional charged defects is studied theoretically. Extended charged defects, considered an important factor for mobility degradation in chemically-vapor-deposited graphene, are…
An efficient computational methodology is used to explore charge transport properties in chemically-modified (and randomly disordered) graphene-based materials. The Hamiltonians of various complex forms of graphene are constructed using…
Using the well-known Kubo formula, we evaluate magnetotransport quantities like the collisional and Hall conductivities of the $\alpha$-T$_3$ model. The collisional conductivity exhibits a series of peaks at strong magnetic field. Each of…
In both research and textbook literature one often finds two ``different'' Kubo formulas for the zero-temperature conductance of a non-interacting Fermi system. They contain a trace of the product of velocity operators and single-particle…
Recently we have introduced the microscopic response method (MRM) to compute the conductivity and Hall mobility for complex system with topological and thermal disorder, which is more convenient than the Kubo formula. We prove that for a…
Using recently developed tools from space-adiabatic perturbation theory, in particular the construction of a non-equilibrium almost stationary state, we give a new proof that the Kubo formula for the Hall conductivity remains valid beyond…
We introduce a linear-scaling real-space methodology to compute time-resolved electrical responses of materials driven far from equilibrium, with energy relaxation and disorder treated on equal footing. Applying this approach to gapped…
We report on a numerical study of quantum transport in disordered two dimensional graphene and graphene nanoribbons. By using the Kubo and the Landauer approaches, transport length scales in the diffusive (mean free path, charge mobilities)…
The traditional Kubo formula is generalized to describe the linear response with respect to non-Abelian fields. To fulfil the demand for studying spin transport, the SU(2) Kubo formulae are derived by two conventional approaches with…
Here we introduce a numerical method for computing conductivity via the Kubo Formula for incommensurate 2D bilayer heterostructures using a tight-binding framework. We begin with deriving the momentum space formulation and Kubo Formula from…
Motivated by recent experiments on rhombohedral stacked multilayer graphene and the observation of the anomalous Hall effect in a spontaneous spin-valley polarized quarter metal state, we calculate the anomalous Hall conductivity for this…
We study a tight binding model including both on site disorder and coupling of the electrons to randomly oriented magnetic moments. The transport properties are calculated via the Kubo-Greenwood scheme, using the exact eigenstates of the…