Match comparison for Hartree energy (match type 26857)

Commits > Commit 3c86545dbb6a164adc7b03c9886fea0d0acfc59e > Input 10-vdw_d3_dna.02-gs_d3.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
3.356150013750000e+02 1.700000000000000e-07 3.356150015300000e+02 5.684341886080801e-14 3.356150015300000e+02 0.000000000000000e+00 PASS

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Detailed information

Reference: 335.615001375, precision: 0.00000017
Run Value Difference Relative difference Status
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_foss_opt_autotools: [foss2023a-serial] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_intel_autotools: [intel2023a-serial] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_foss_omp_autotools: [foss2023a-serial] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_intel_omp_autotools: [intel2022a-serial] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_intel_omp_autotools: [intel2023a-serial] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_foss_ppc_autotools: [foss2022a-serial] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_foss_min_autotools: [foss2023a-serial] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_foss_min_autotools: [foss2022a-serial] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_foss_autotools: [foss2022a-serial] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_foss_autotools: [foss2023a-serial] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_foss_min_autotools: [foss2023b-serial] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_foss_autotools: [foss2023b-serial] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_foss_debug_autotools: [foss2023a-serial] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] 3.356150015300000e+02 1.549999524286250e-07 9.117644260507352e-01 PASS