jaemolihm/pw2w90_test_irrbz

pw2w90_test

Test suite for pw2wannier90.x program of Quantum ESPRESSO.

Tests the irr_bz implementation by Takashi Koretsune. https://github.com/wannier-utils-dev/symWannier

How to run the tests

• Modify file environment_variables (program paths and run commands)
  • In the first run, set GENERATE_REFERENCE to true to generate reference data.
  • In later runs, set GENERATE_REFERENCE to false to skip reference data generation.
• Run tests by ./run_tests.sh
  • All tests (except library mode test) are run by default
  • Specific tests can be run by passing the folder names (e.g. ./run_tests.sh fe gaas)
  • SCDM tests can be run by calling ./run_tests.sh scdm)