Match comparison for Hartree (match type 24572)

Commits > Commit 94d58911903c32860449c62a795f2d74d19217f9 > Input 04-lithium.01-ground_state.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
2.706538100000000e+00 1.140000000000000e-06 2.706537550857143e+00 1.773353793952225e-07 2.706537455000000e+00 2.350000001261066e-07 PASS

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Detailed information

Reference: 2.7065381, precision: 0.00000114
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] 2.706537320000000e+00 -7.800000001445540e-07 -6.842105264425912e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] 2.706537320000000e+00 -7.800000001445540e-07 -6.842105264425912e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] 2.706537320000000e+00 -7.800000001445540e-07 -6.842105264425912e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] 2.706537690000000e+00 -4.099999997286830e-07 -3.596491225690201e-01 PASS
foss_min_autotools: [foss2022a-serial] 2.706537690000000e+00 -4.099999997286830e-07 -3.596491225690201e-01 PASS
foss_min_autotools: [foss2023b-serial] 2.706537690000000e+00 -4.099999997286830e-07 -3.596491225690201e-01 PASS
foss_min_autotools: [foss2023a-serial] 2.706537690000000e+00 -4.099999997286830e-07 -3.596491225690201e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] 2.706537320000000e+00 -7.800000001445540e-07 -6.842105264425912e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] 2.706537690000000e+00 -4.099999997286830e-07 -3.596491225690201e-01 PASS
foss_autotools: [foss2022a-serial] 2.706537690000000e+00 -4.099999997286830e-07 -3.596491225690201e-01 PASS
foss_opt_autotools: [foss2023a-serial] 2.706537690000000e+00 -4.099999997286830e-07 -3.596491225690201e-01 PASS
foss_autotools: [foss2023a-serial] 2.706537690000000e+00 -4.099999997286830e-07 -3.596491225690201e-01 PASS
foss_autotools: [foss2023b-serial] 2.706537690000000e+00 -4.099999997286830e-07 -3.596491225690201e-01 PASS
intel_autotools: [intel2023a-serial] 2.706537360000000e+00 -7.399999999435636e-07 -6.491228069680381e-01 PASS
foss_mpi_min_autotools: [foss2022a-mpi] 2.706537690000000e+00 -4.099999997286830e-07 -3.596491225690201e-01 PASS
foss_omp_autotools: [foss2023a-serial] 2.706537500000000e+00 -5.999999999062311e-07 -5.263157893914308e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] 2.706537690000000e+00 -4.099999997286830e-07 -3.596491225690201e-01 PASS
foss_mpi_min_autotools: [foss2023a-mpi] 2.706537690000000e+00 -4.099999997286830e-07 -3.596491225690201e-01 PASS
foss_debug_autotools: [foss2023a-serial] 2.706537690000000e+00 -4.099999997286830e-07 -3.596491225690201e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] 2.706537690000000e+00 -4.099999997286830e-07 -3.596491225690201e-01 PASS
intel_omp_autotools: [intel2023a-serial] 2.706537490000000e+00 -6.099999998454564e-07 -5.350877191626809e-01 PASS
intel_omp_autotools: [intel2022a-serial] 2.706537230000000e+00 -8.700000000416708e-07 -7.631578947733954e-01 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] 2.706537690000000e+00 -4.099999997286830e-07 -3.596491225690201e-01 PASS
foss_mpi_autotools: [foss2022a-mpi] 2.706537690000000e+00 -4.099999997286830e-07 -3.596491225690201e-01 PASS
foss_mpi_autotools: [foss2023a-mpi] 2.706537690000000e+00 -4.099999997286830e-07 -3.596491225690201e-01 PASS
foss_ppc_autotools: [foss2022a-serial] 2.706537590000000e+00 -5.100000000091143e-07 -4.473684210606265e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] 2.706537480000000e+00 -6.199999997846817e-07 -5.438596489339312e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] 2.706537690000000e+00 -4.099999997286830e-07 -3.596491225690201e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] 2.706537690000000e+00 -4.099999997286830e-07 -3.596491225690201e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] 2.706537360000000e+00 -7.399999999435636e-07 -6.491228069680381e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] 2.706537690000000e+00 -4.099999997286830e-07 -3.596491225690201e-01 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] 2.706537500000000e+00 -5.999999999062311e-07 -5.263157893914308e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] 2.706537230000000e+00 -8.700000000416708e-07 -7.631578947733954e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 2.706537220000000e+00 -8.799999999808961e-07 -7.719298245446456e-01 PASS
foss_valgrind_autotools: [foss2023a-serial] 2.706537240000000e+00 -8.600000001024455e-07 -7.543859650021451e-01 PASS