Input 10-bomd.02-td.inp

Commits > Commit b7dcc99023940be2b83de00317ffa33e598f3f55 > Run foss_opt_autotools: [foss2023a-serial]

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -1.058173966828875e+01 -1.058173966727794e+01 1.110000000000000e-09 -1.010805661394443e-09 PASS
Energy [step 2] -1.058158908445420e+01 -1.058158908323670e+01 1.340000000000000e-09 -1.217498990513377e-09 PASS
Energy [step 3] -1.058145774227812e+01 -1.058145773976836e+01 2.760000000000000e-09 -2.509755958612914e-09 PASS
Energy [step 4] -1.058134610395850e+01 -1.058134609837600e+01 6.140000000000000e-09 -5.582503348477985e-09 PASS
Forces [step 1] -1.538478572155718e-01 -1.538477490161310e-01 1.190000000000000e-07 -1.081994407681197e-07 PASS
Forces [step 2] -1.732216535538546e-01 -1.732217491278353e-01 1.050000000000000e-07 9.557398070181300e-08 PASS
Forces [step 3] -1.918267217379046e-01 -1.918264519676630e-01 2.970000000000000e-07 -2.697702415899172e-07 PASS
Forces [step 4] -2.092292171997943e-01 -2.092290828484236e-01 1.480000000000000e-07 -1.343513706952848e-07 PASS
Compare to other inputs