/wanPB

Converting Wannier90's Hamiltonian to pybinding compatible format.

Primary LanguagePython

wanPB

Converting Wannier90's Hamiltonian to pybinding compatible format.

Prerequisites:

  • python3.6+
  • pybinding
  • numpy

Usage

Input files:

  • seedname_centres.xyz
  • seedname_tb.dat

Command-line interface:

w90_pb --seedname "wannier90"

Output file:

  • seedname.pbz (check out this page for how to use this file with pybinding.)