Input 10-bomd.02-td.inp

Commits > Commit 9972eae3cc35bad71f44bb929051f5e204f853a2 > Run intel-serial: [intel2023a-serial]

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -1.058173966828878e+01 -1.058173966727794e+01 1.110000000000000e-09 -1.010837635817552e-09 PASS
Energy [step 2] -1.058158908445420e+01 -1.058158908323670e+01 1.340000000000000e-09 -1.217498990513377e-09 PASS
Energy [step 3] -1.058145774227835e+01 -1.058145773976836e+01 2.760000000000000e-09 -2.509985108645196e-09 PASS
Energy [step 4] -1.058134610389379e+01 -1.058134609837600e+01 6.140000000000000e-09 -5.517794221532313e-09 PASS
Forces [step 1] -1.538478572155728e-01 -1.538477490161310e-01 1.190000000000000e-07 -1.081994417950760e-07 PASS
Forces [step 2] -1.732216535539427e-01 -1.732217491278353e-01 1.050000000000000e-07 9.557389263337157e-08 PASS
Forces [step 3] -1.918267217655915e-01 -1.918264519676630e-01 2.970000000000000e-07 -2.697979285259944e-07 PASS
Forces [step 4] -2.092292079161169e-01 -2.092290828484236e-01 1.480000000000000e-07 -1.250676932851302e-07 PASS
Compare to other inputs