# 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
# tests GAPW ext basis sets
"H2S-e1.inp"                            = [{matcher="E_total", tol=5e-13, ref=-11.30826768946058}]
"H2S-e2.inp"                            = [{matcher="E_total", tol=5e-13, ref=-11.30826685294312}]
"H2S-e3.inp"                            = [{matcher="E_total", tol=5e-13, ref=-11.30821433565813}]
"H2S-e4.inp"                            = [{matcher="E_total", tol=5e-13, ref=-11.30818159686934}]
"H2O-e1.inp"                            = [{matcher="E_total", tol=8e-13, ref=-17.16408671493325}]
"H2O-e2.inp"                            = [{matcher="E_total", tol=5e-13, ref=-17.16377543876715}]
"H2O-e3.inp"                            = [{matcher="E_total", tol=5e-13, ref=-17.16475812438971}]
#EOF

