# 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
# test mulliken constraints
H2O-field-gopt.inp                                     1      3e-11              -5.76960964769063
H2O-field-gopt-lsd.inp                                 1      4e-12              -5.76960970095199
H2O-field.inp                                          0      4e-13
H2O-field-lsd.inp                                      1      4e-14              -5.76948986131183
HF-field.inp                                           1      1e-12              -5.62817044142137
HF-field-gopt.inp                                      1      5e-09              -5.66333179696722
HF-field-debug.inp                                     0      1e-12
HF-dfilter-debug.inp                                   0      1e-12
HF-dfield-gopt.inp                                     1      1e-09              -5.66113975858277
HF-dfield.inp                                          1      1e-12              -5.66099020966660
HF-dfield-debug.inp                                    0      1e-12
HF-loc-field.inp                                       1      1e-12              -5.65286303322644
HF-loc-field-gopt.inp                                  1      5e-09              -5.67065466488875
HF-loc-field-debug.inp                                 0      1e-12
#EOF
