Match comparison for z (H1) (t=400 au) (match type 26062)

Commits > Commit 3c86545dbb6a164adc7b03c9886fea0d0acfc59e > Input 11-dftbplus_ehrenfest.01-benzene.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
2.388638060000000e+00 1.000000000000000e-04 2.388644100081989e+00 3.402246137205944e-14 2.388644100081964e+00 7.238654120556021e-14 PASS

Checks for this match

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Detailed information

Reference: 2.38863806, precision: 0.0001
Run Value Difference Relative difference Status
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] 2.388644100081991e+00 6.040081991010027e-06 6.040081991010027e-02 PASS
GCI_foss_opt_autotools: [foss2023a-serial] 2.388644100081991e+00 6.040081991010027e-06 6.040081991010027e-02 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] 2.388644100081991e+00 6.040081991010027e-06 6.040081991010027e-02 PASS
GCI_intel_autotools: [intel2023a-serial] 2.388644100081982e+00 6.040081982128243e-06 6.040081982128243e-02 PASS
GCI_foss_omp_autotools: [foss2023a-serial] 2.388644100082037e+00 6.040082036751215e-06 6.040082036751215e-02 PASS
GCI_intel_omp_autotools: [intel2022a-serial] 2.388644100082011e+00 6.040082010994041e-06 6.040082010994041e-02 PASS
GCI_intel_omp_autotools: [intel2023a-serial] 2.388644100082011e+00 6.040082010994041e-06 6.040082010994041e-02 PASS
GCI_foss_ppc_autotools: [foss2022a-serial] 2.388644100081892e+00 6.040081891978133e-06 6.040081891978133e-02 PASS
GCI_foss_autotools: [foss2022a-serial] 2.388644100081991e+00 6.040081991010027e-06 6.040081991010027e-02 PASS
GCI_foss_autotools: [foss2023a-serial] 2.388644100081991e+00 6.040081991010027e-06 6.040081991010027e-02 PASS
GCI_foss_autotools: [foss2023b-serial] 2.388644100081991e+00 6.040081991010027e-06 6.040081991010027e-02 PASS