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Code to compute a TB Hamiltonian

An evolving package to compute tight-binding Hamiltonians.

MPI

Band structure

  1. multiprocessing package for core-only parallelization
  2. mpi4py package for MPI parallelization

If using mpi4py, install the mpi optional dependencies with pip install .[mpi].

If pip fails to build the package, you could try this stackoverflow discussion.

If this does not work, you can install mpi4py using conda (or mamba).