# 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
#GEEP library
H2O-qmmm-gauss-14-geep-2.inp                           1      5e-14             -12.90417644796692
H2O-qmmm-gauss-14-geep-3.inp                           1    1.0E-14             -12.90712061196071
H2O-qmmm-gauss-14-geep-4.inp                           1      1e-13             -12.90733560862245
H2O-qmmm-gauss-14-geep-5.inp                           1      3e-14             -12.92642686633922
H2O-qmmm-gauss-14-geep-6.inp                           1      1e-13            -12.922306022304049
H2O-qmmm-gauss-14-geep-7.inp                           1      8e-14             -12.91849696653665
H2O-qmmm-gauss-14-geep-8.inp      1     3e-14             -12.91621682584684
H2O-qmmm-gauss-14-geep-9.inp                           1      9e-14            -12.914371661785999
H2O-qmmm-gauss-14-geep-10.inp                          1      3e-14             -12.91328069126081
H2O-qmmm-gauss-14-geep-11.inp                          1      3e-14             -12.91297474165067
H2O-qmmm-gauss-14-geep-12.inp                          1      5e-14             -12.91332340555361
H2O-qmmm-gauss-14-geep-13.inp                          1      6e-14             -12.91325023093564
H2O-qmmm-gauss-14-geep-14.inp                          1      9e-14             -12.91299456139047
H2O-qmmm-gauss-14-geep-15.inp                          1      6e-14             -12.91325018773841
H2O-qmmm-gauss-14-geep-16.inp     1     2e-14             -12.91325925146546
H2O-qmmm-gauss-14-geep-17.inp     1     6e-14            -12.913367183821659
H2O-qmmm-gauss-14-geep-18.inp                          1      8e-14              -12.9133675363151
#EOF
