# 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
#      46 compares final value of Powell optimization
#      for details see cp2k/tools/do_regtest
# LRIGPW
H2He_tz2p_lri.inp                 1     6e-12
H2_tz2p_lri_diag.inp              1     8e-12
H2_tz2p_lri_ot.inp                1     9e-12
O2_opt_lribas.inp                 46
O2_opt_lribas_contract.inp        46
O2_debug_ints.inp                 0
