Match comparison for y (C6) (t=400 au) (match type 26049)

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

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-9.455055999999999e-01 1.000000000000000e-04 -9.455131153165443e-01 1.038092260553269e-14 -9.455131153165507e-01 1.976196983832779e-14 PASS

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Detailed information

Reference: -0.9455056, precision: 0.0001
Run Value Difference Relative difference Status
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] -9.455131153165417e-01 -7.515316541750749e-06 -7.515316541750749e-02 PASS
GCI_foss_opt_autotools: [foss2023a-serial] -9.455131153165417e-01 -7.515316541750749e-06 -7.515316541750749e-02 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] -9.455131153165417e-01 -7.515316541750749e-06 -7.515316541750749e-02 PASS
GCI_intel_autotools: [intel2023a-serial] -9.455131153165504e-01 -7.515316550410489e-06 -7.515316550410489e-02 PASS
GCI_foss_omp_autotools: [foss2023a-serial] -9.455131153165525e-01 -7.515316552519913e-06 -7.515316552519913e-02 PASS
GCI_intel_omp_autotools: [intel2022a-serial] -9.455131153165309e-01 -7.515316530981586e-06 -7.515316530981586e-02 PASS
GCI_intel_omp_autotools: [intel2023a-serial] -9.455131153165309e-01 -7.515316530981586e-06 -7.515316530981586e-02 PASS
GCI_foss_ppc_autotools: [foss2022a-serial] -9.455131153165705e-01 -7.515316570505526e-06 -7.515316570505526e-02 PASS
GCI_foss_autotools: [foss2022a-serial] -9.455131153165417e-01 -7.515316541750749e-06 -7.515316541750749e-02 PASS
GCI_foss_autotools: [foss2023a-serial] -9.455131153165417e-01 -7.515316541750749e-06 -7.515316541750749e-02 PASS
GCI_foss_autotools: [foss2023b-serial] -9.455131153165417e-01 -7.515316541750749e-06 -7.515316541750749e-02 PASS