PAOFLOW.pyskeaf#
pyskeaf — Python port of the Supercell K-space Extremal Area Finder (SKEAF).
Reference: P.M.C. Rourke and S.R. Julian, Comput. Phys. Commun. 183, 324 (2012). Original Fortran 90 source: skeaf_v1p3p0_r149.F90 by Patrick Rourke.
Public API (Phase 1 — I/O only):
from pyskeaf import read_bxsf, BXSFData from pyskeaf import SkeafConfig, read_config_in, write_config_in from pyskeaf import SKEAFResult, Orbit