# 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
ch2o.inp                                   1    1.0E-12              -7.84456570296343
ch2o_geo.inp                               1    1.0E-12              -7.84652942485169
ch2o_lsd.inp                               1    1.0E-12              -7.19650182424155
ch2o_smear.inp                             1    1.0E-12              -7.19650182424155
tmol.inp                                   1    1.0E-12             -41.90853885813245
h2.inp                                     1    1.0E-12              -1.03458223634251
h2_kab.inp                                 1    1.0E-12              -0.99816707611986
h2o-md.inp                                 1    1.0E-12            -185.14802701162756
h2o_str.inp                                1    1.0E-12              -5.76547341028092
h2o-atprop.inp                             1    1.0E-10            -185.16704903931230
h2o-atprop0.inp                            1    1.0E-12            -187.45499307089042
si_geo.inp                                 1    1.0E-12             -14.55678348978414
si_kp.inp                                  1    1.0E-12             -14.75431716922754
h2o_dimer.inp                              1    1.0E-12             -11.54506384130837
ghost.inp                                  1    1.0E-12              -1.03458221876736
#EOF
