Input 16-bomd.02-td.inp

Commits > Commit 16a288d93f4684890591c6dab8ffeadb82c84e9a > Run intel_omp_autotools: [intel2023a-serial]

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -1.058173966828877e+01 -1.058173966727793e+01 1.110000000000000e-09 -1.010841188531231e-09 PASS
Energy [step 2] -1.058158908445421e+01 -1.058158908323673e+01 1.340000000000000e-09 -1.217477674231304e-09 PASS
Energy [step 3] -1.058145774227813e+01 -1.058145773976834e+01 2.760000000000000e-09 -2.509786156679183e-09 PASS
Energy [step 4] -1.058134610395196e+01 -1.058134609837270e+01 6.140000000000000e-09 -5.579263273602919e-09 PASS
Forces [step 1] -1.538478572155724e-01 -1.538477490161332e-01 1.190000000000000e-07 -1.081994391582963e-07 PASS
Forces [step 2] -1.732216535538501e-01 -1.732217491278016e-01 1.050000000000000e-07 9.557395155845860e-08 PASS
Forces [step 3] -1.918267217408167e-01 -1.918264519326440e-01 2.970000000000000e-07 -2.698081727203760e-07 PASS
Forces [step 4] -2.092292163248418e-01 -2.092290824096458e-01 1.470000000000000e-07 -1.339151959878215e-07 PASS
Compare to other inputs