/bilayer_tight_binding

Publication-ready directory for single and bi-layer graphene DFT tight-binding models under lattice deformation.

Primary LanguagePython

Package directory for bilayer tight binding model

Directory structure

  • bilayer_letb/ - Main code package
  • workflow/ - Workflow files for generating data/
  • data/ - Dataset for fitting
  • fit/ - Fitting methods for parameters using data/
  • examples/ - Simple examples using our model to generate band structures

Install and import model

pip install bilayer_letb
from bilayer_letb.api import tb_model

Full code repository: https://github.com/qmc-hamm/bilayer_tight_binding