Kwant: a software package for quantum transport

Abstract Kwant is a Python package for numerical quantum transport calculations. It aims to be a user-friendly, universal, and high-performance toolbox for the simulation of physical systems of any dimensionality and geometry that can be described by a tight-binding model. Kwant has been designed such that the natural concepts of the theory of quantum transport (lattices, symmetries, electrodes, orbital/spin/electron-hole degrees of freedom) are exposed in a simple and transparent way. Defining a new simulation setup is very similar to describing the corresponding mathematical model. Kwant offers direct support for calculations of transport properties (conductance, noise, scattering matrix), dispersion…