Welcome to Quantum Electrostatic Heterostructure Model’s documentation!

The quantum electrostatic heterostructure (QEH) model is a fast and accurate model for simulating optical properties of stacks of 2D materials (heterostructures). This python package implements an easy command line interface to quickly calculate hetorostructure properties.

See also

Efficient Ab Initio Modeling of Dielectric Screening in 2D van der Waals Materials: Including Phonons, Substrates, and Doping

    1. Gjerding*, L. S. R. Cavalcante, Andrey Chaves, and K. S. Thygesen

J. Phys. Chem. C 2020, 124, 21, 11609–11616

Minimal example of calculating the plasmons of a graphene boron nitride heterostructure:

$ qeh graphene+doping=0.5 3BN graphene+doping=0.5 --plasmons --plot

Indices and tables