xoppylib.xoppy_run_binaries

Utilities for running XOPPY external Fortran/C binaries (URGENT, US, SRW wrappers).

Functions

run_external_binary([binary, post_command, info])
xoppy_calc_inpro([CRYSTAL_MATERIAL, MODE, ...])
xoppy_calc_powder_fml([FILE, TITLE, LAMBDA, ...])
xoppy_calc_ws([ENERGY, CUR, PERIOD, N, KX, ...])
xoppy_calc_xcom([NAME, SUBSTANCE, ...])
xoppy_calc_xtc([ENERGY, CURRENT, ...])
xoppy_calc_xtcap([ENERGY, CURRENT, ...])
xoppy_calc_xtube_w([VOLTAGE, RIPPLE, AL_FILTER])
xoppy_calc_xtubes([ITUBE, VOLTAGE])
xoppy_calc_yaup([TITLE, PERIOD, NPER, NPTS, ...])