# 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_apt.inp"                           = [{matcher="M096", tol=1e-06, ref=-0.879586}]
"h2o_apt_dyn.inp"                       = [{matcher="M096", tol=1e-06, ref=-0.776093}]
"h2o_apt_z-matrix.inp"                  = [{matcher="M096", tol=1e-06, ref=-0.882548}]
"h2o_apt_uks.inp"                       = [{matcher="M096", tol=1e-06, ref=-0.879582}]
"h2o_apt_uks_z-matrix.inp"              = [{matcher="M096", tol=1e-06, ref=-0.882544}]
"h2o_apt_loc.inp"                       = [{matcher="M096", tol=1e-06, ref=-0.879586}]
"h2o_apt_pbc.inp"                       = [{matcher="M096", tol=1e-06, ref=-0.938707}]
"h2o_apt_pbc_loc.inp"                   = [{matcher="M096", tol=1e-06, ref=-0.938770}]
"h2o_aat.inp"                           = [{matcher="M100", tol=1e-06, ref=-0.857427}]
"h2o_apt_fdiff.inp"                     = [{matcher="M127", tol=1e-04, ref=0.0028031231}]
#EOF
