# 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
h2o_ot_refine_1.inp                                    1      1e-13             -17.15555830623747
h2o_ot_refine_2.inp                                    1      2e-13             -17.09533893327906
h2o_ot_refine_diis_1.inp                               1      7e-14             -17.16034285286430
h2o_ot_refine_diis_2.inp                               1      3e-14             -17.13286784415029
o2_ot_refine_1.inp                                     1      1e-13             -31.50322326962441
o2_ot_refine_2.inp                                     1      1e-13             -31.29867256671142
o2_ot_refine_diis_1.inp                                1      8e-14             -31.68975974949591
o2_ot_refine_diis_2.inp                                1      5e-14             -31.26277230138910
ethylene_l1_loc.inp                                   13    1.0E-14               0.4063601640E+02
o2_ot_refine_roks.inp                                  1      1e-13             -31.23722653728602
#EOF
