Input 10-bomd.02-td.inp

Commits > Commit f8aeac8acec97cad57d0dc81a915c34dc5591a3a > Run foss-opt-full: [foss2023a-serial]

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -1.058173966828876e+01 -1.058173966727794e+01 1.110000000000000e-09 -1.010816319535479e-09 PASS
Energy [step 2] -1.058158908445420e+01 -1.058158908323670e+01 1.340000000000000e-09 -1.217497214156538e-09 PASS
Energy [step 3] -1.058145774227811e+01 -1.058145773976836e+01 2.760000000000000e-09 -2.509754182256074e-09 PASS
Energy [step 4] -1.058134610396421e+01 -1.058134609837600e+01 6.140000000000000e-09 -5.588207230289299e-09 PASS
Forces [step 1] -1.538478572155705e-01 -1.538477490161310e-01 1.190000000000000e-07 -1.081994394636077e-07 PASS
Forces [step 2] -1.732216535538430e-01 -1.732217491278353e-01 1.050000000000000e-07 9.557399233139918e-08 PASS
Forces [step 3] -1.918267217356213e-01 -1.918264519676630e-01 2.970000000000000e-07 -2.697679583330004e-07 PASS
Forces [step 4] -2.092292180487870e-01 -2.092290828484236e-01 1.480000000000000e-07 -1.352003634047527e-07 PASS
Compare to other inputs