Match comparison for Hartree energy (match type 26101)

Commits > Commit 3c86545dbb6a164adc7b03c9886fea0d0acfc59e > Input 18-TiO2.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
4.244778760000000e+01 9.680000000000001e-07 4.244778715846154e+01 3.619572040018205e-07 4.244778759500000e+01 6.550000009042378e-07 PASS
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Detailed information

Reference: 42.4477876, precision: 0.000000968
Run Value Difference Relative difference Status
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] 4.244778761000000e+01 1.000000082740371e-08 1.033057936715259e-02 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] 4.244778701000000e+01 -5.899999990788274e-07 -6.095041312797803e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] 4.244778701000000e+01 -5.899999990788274e-07 -6.095041312797803e-01 PASS
GCI_foss_opt_autotools: [foss2023a-serial] 4.244778695000000e+01 -6.499999969378223e-07 -6.714876001423783e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] 4.244778695000000e+01 -6.499999969378223e-07 -6.714876001423783e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] 4.244778695000000e+01 -6.499999969378223e-07 -6.714876001423783e-01 PASS
GCI_intel_autotools: [intel2023a-serial] 4.244778696000000e+01 -6.399999961104186e-07 -6.611570207752258e-01 PASS
GCI_foss_omp_autotools: [foss2023a-serial] 4.244778699000000e+01 -6.100000007336348e-07 -6.301652900140855e-01 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] 4.244778780000000e+01 2.000000023372195e-07 2.066115726624168e-01 PASS
GCI_intel_omp_autotools: [intel2022a-serial] 4.244778694000000e+01 -6.599999977652260e-07 -6.818181795095309e-01 PASS
GCI_intel_omp_autotools: [intel2023a-serial] 4.244778694000000e+01 -6.599999977652260e-07 -6.818181795095309e-01 PASS
GCI_foss_ppc_autotools: [foss2022a-serial] 4.244778825000000e+01 6.500000040432496e-07 6.714876074826959e-01 PASS
GCI_foss_min_autotools: [foss2023a-serial] 4.244778695000000e+01 -6.499999969378223e-07 -6.714876001423783e-01 PASS
GCI_foss_min_autotools: [foss2022a-serial] 4.244778695000000e+01 -6.499999969378223e-07 -6.714876001423783e-01 PASS
GCI_foss_autotools: [foss2022a-serial] 4.244778695000000e+01 -6.499999969378223e-07 -6.714876001423783e-01 PASS
GCI_foss_autotools: [foss2023a-serial] 4.244778695000000e+01 -6.499999969378223e-07 -6.714876001423783e-01 PASS
GCI_foss_min_autotools: [foss2023b-serial] 4.244778695000000e+01 -6.499999969378223e-07 -6.714876001423783e-01 PASS
GCI_foss_autotools: [foss2023b-serial] 4.244778695000000e+01 -6.499999969378223e-07 -6.714876001423783e-01 PASS
GCI_foss_debug_autotools: [foss2023a-serial] 4.244778695000000e+01 -6.499999969378223e-07 -6.714876001423783e-01 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] 4.244778761000000e+01 1.000000082740371e-08 1.033057936715259e-02 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] 4.244778761000000e+01 1.000000082740371e-08 1.033057936715259e-02 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] 4.244778701000000e+01 -5.899999990788274e-07 -6.095041312797803e-01 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] 4.244778701000000e+01 -5.899999990788274e-07 -6.095041312797803e-01 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] 4.244778784000000e+01 2.399999985414070e-07 2.479338827907097e-01 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] 4.244778701000000e+01 -5.899999990788274e-07 -6.095041312797803e-01 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] 4.244778702000000e+01 -5.799999982514237e-07 -5.991735519126277e-01 PASS