Contents
CrystalData
Dimer
FourStateConfig
crystal_from_cif()
read_poscar()
write_poscar()
get_mm_distances()
group_inequivalent()
get_distance_shells()
lattice_matrix()
frac_to_cart()
get_cartesian_coords()
expand_supercell()
check_coupling_spacing()
find_dimers()
find_symmetry_ops()
build_reference_bath()
generate_four_states()
find_unique_configs()
run_cif_analysis()
magmom_to_udn()
build_udn_lines()
find_instgen()
write_case_inst_files()
write_case_struct_files()
write_struct_file()
EnergyResult
extract_vasp_energy()
extract_wien2k_energy()
get_energy()
Formula
JResult
parse_report_formulas()
compute_j_values()
read_all_energies()
write_j_values_dat()
mag4.magnon
mag4.analysis
mag4.cli
CLI: M – L – M bridging-angle analysis from a CIF.
Functions
build_parser()
build_parser
main([argv])
main
ArgumentParser
int