# runs are executed in the same order as in this file
# the second field tells which test should be run in order to compare with the last available output
# e.g. 0 means do not compare anything, running is enough
#      1 compares the last total energy in the file
#      for details see cp2k/tools/do_regtest
#
# spglib-dependent tests
"c_cell_opt_kpsym_guard.inp"            = [{matcher="N_special_kpoints", tol=0.0, ref=1}]
"c_debug_kpsym_default.inp"             = [{matcher="N_special_kpoints", tol=0.0, ref=4}]
"c_debug_kpsym_full.inp"                = [{matcher="N_special_kpoints", tol=0.0, ref=3}]
"c_geo_opt_kpsym_spglib.inp"            = [{matcher="N_special_kpoints", tol=0.0, ref=1}]
"c_spglib_backend_gamma_real_wfn.inp"   = [{matcher="E_total", tol=1e-13, ref=-45.10384660417728},
                                           {matcher="N_special_kpoints", tol=0.0, ref=1}]
"h_spglib_sym_red.inp"                  = [{matcher="E_total", tol=1e-13, ref=-4.34916646889997}]
"h_spglib_sym_red_restart.inp"          = [{matcher="E_total", tol=1e-8, ref=-4.34916647312477}]
"h_hex_c3_sym_red.inp"                  = [{matcher="E_total", tol=1e-8, ref=-9.17691856252346},
                                           {matcher="N_special_kpoints", tol=0.0, ref=9}]
"h_hex_c3_gamma_spglib.inp"             = [{matcher="E_total", tol=1e-7, ref=-9.29840881688658},
                                           {matcher="N_special_kpoints", tol=0.0, ref=20}]
"h_hex_c3_gamma_macdonald_spglib.inp"   = [{matcher="E_total", tol=1e-7, ref=-9.29866167374671},
                                           {matcher="N_special_kpoints", tol=0.0, ref=32}]
#EOF
