# 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              -5.76970818700878
H2O-field-gopt-lsd.inp                                 1      4e-12              -5.76970797174834
H2O-field.inp                                          0      4e-13
H2O-field-lsd.inp                                      1      4e-14              -5.76959233315201
HF-field.inp                                           1      1e-12              -5.62813329327978
HF-field-gopt.inp                                      1      5e-09              -5.66367831097363
HF-field-debug.inp                                     0      1e-12
HF-dfilter-debug.inp                                   0      1e-12
HF-dfield-gopt.inp                                     1      1e-09              -5.66065888870620
HF-dfield.inp                                          1      1e-12              -5.66052242442153
HF-dfield-debug.inp                                    0      1e-12
HF-loc-field.inp                                       1      1e-12              -5.65286303322644
HF-loc-field-gopt.inp                                  1      2e-08              -5.67004654243380
HF-loc-field-debug.inp                                 0      1e-12
#EOF
