hcn_ts.inp                                             7      3e-10           -0.58467641930000003
hcn_ts_r.inp                                           7      1e-07                    0.084182408
hcn_ts_kdimer.inp                                          7      1e-07           -0.0006648450 
# dimer method with fixed atom constraints
hcn_ts_fix_e.inp                  7     7e-07                  -0.0641022960
hcn_ts_fix_x.inp                                      63      1e-14             1.2200000000
hcn_ts_fix_y.inp                                      64      1e-14            -0.0003000000
hcn_ts_fix_z.inp                                      65      1e-14             0.0000000000
# chain of two coordination numbers
hcn_md.inp                                             1      2e-14             -16.50121471894339
hcn_meta_coord.inp                                     1      4e-14            -16.651136320178662
hcn_meta_chaincoord.inp                                1      7e-14             -16.64019903515767
hcn_meta_chaincoord_kind.inp                           1      1e-13             -16.64019903515767
# Population colvar
H2O_meta_pop.inp                                       1      5e-08            -17.155197480118499
# Metadynamics with langevin on COLVAR
H2O_meta_langevin.inp                                  1      2e-07             -17.16840571384963
#gyration radius
Au13ico_mtd.inp                                        1      2e-13            -433.32356092160364
# rmsd AB
Au12_rmsd_AB_mtd.inp                                   1      3e-11            -397.79483290645879
Au12_rmsd_A_mtd.inp                                    1      2e-11            -397.77606666203451
# tpss new input
H2O-tpss_lsd.inp                                       1      3e-13             -34.34058398102035
#EOF
