Match comparison for Hartree (match type 24572)

Commits > Commit 6099f031302cffa2938f492784ba2f7b55faffa3 > Input 04-lithium.01-ground_state.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
2.706538100000000e+00 1.140000000000000e-06 2.706537958709677e+00 3.020440251080377e-07 2.706537680000000e+00 6.200000000067263e-07 PASS

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Detailed information

Reference: 2.7065381, precision: 0.00000114
Run Value Difference Relative difference Status
foss_min_autotools: [foss2022a-serial] 2.706538110000000e+00 9.999999939225290e-09 8.771929771250254e-03 PASS
foss_min_autotools: [foss2023a-serial] 2.706538110000000e+00 9.999999939225290e-09 8.771929771250254e-03 PASS
foss_min_autotools: [foss2023b-serial] 2.706538110000000e+00 9.999999939225290e-09 8.771929771250254e-03 PASS
foss_opt_autotools: [foss2023a-serial] 2.706538110000000e+00 9.999999939225290e-09 8.771929771250254e-03 PASS
foss_autotools: [foss2022a-serial] 2.706538110000000e+00 9.999999939225290e-09 8.771929771250254e-03 PASS
foss_autotools: [foss2023a-serial] 2.706538110000000e+00 9.999999939225290e-09 8.771929771250254e-03 PASS
foss_cmake: [foss2022a-serial, foss-min] 2.706538110000000e+00 9.999999939225290e-09 8.771929771250254e-03 PASS
intel_autotools: [intel2023a-serial] 2.706537720000000e+00 -3.799999999110071e-07 -3.333333332552693e-01 PASS
foss_autotools: [foss2023b-serial] 2.706538110000000e+00 9.999999939225290e-09 8.771929771250254e-03 PASS
foss_cmake: [foss2022a-serial, foss-full] 2.706538110000000e+00 9.999999939225290e-09 8.771929771250254e-03 PASS
foss_mpi_min_autotools: [foss2023a-mpi] 2.706538110000000e+00 9.999999939225290e-09 8.771929771250254e-03 PASS
foss_omp_autotools: [foss2023a-serial] 2.706537060000000e+00 -1.039999999896679e-06 -9.122807016637535e-01 PASS
foss_cmake_mpi_min: [foss2022a-mpi] 2.706538110000000e+00 9.999999939225290e-09 8.771929771250254e-03 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] 2.706538110000000e+00 9.999999939225290e-09 8.771929771250254e-03 PASS
foss_mpi_min_autotools: [foss2022a-mpi] 2.706538110000000e+00 9.999999939225290e-09 8.771929771250254e-03 PASS
foss_mpi_autotools: [foss2023a-mpi] 2.706538110000000e+00 9.999999939225290e-09 8.771929771250254e-03 PASS
foss_mpi_autotools: [foss2022a-mpi] 2.706538110000000e+00 9.999999939225290e-09 8.771929771250254e-03 PASS
intel_omp_autotools: [intel2022a-serial] 2.706538060000000e+00 -3.999999975690116e-08 -3.508771908500102e-02 PASS
foss_debug_autotools: [foss2023a-serial] 2.706538110000000e+00 9.999999939225290e-09 8.771929771250254e-03 PASS
foss_cmake_mpi_min: [foss2023a-mpi] 2.706538110000000e+00 9.999999939225290e-09 8.771929771250254e-03 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] 2.706538110000000e+00 9.999999939225290e-09 8.771929771250254e-03 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] 2.706538110000000e+00 9.999999939225290e-09 8.771929771250254e-03 PASS
intel_omp_autotools: [intel2023a-serial] 2.706537760000000e+00 -3.400000001541059e-07 -2.982456141702683e-01 PASS
foss_ppc_autotools: [foss2022a-serial] 2.706537800000000e+00 -2.999999999531155e-07 -2.631578946957154e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] 2.706538110000000e+00 9.999999939225290e-09 8.771929771250254e-03 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] 2.706537060000000e+00 -1.039999999896679e-06 -9.122807016637535e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] 2.706538060000000e+00 -3.999999975690116e-08 -3.508771908500102e-02 PASS
foss_valgrind_autotools: [foss2023a-serial] 2.706537490000000e+00 -6.099999998454564e-07 -5.350877191626809e-01 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] 2.706538300000000e+00 2.000000001167734e-07 1.754385965936609e-01 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 2.706537490000000e+00 -6.099999998454564e-07 -5.350877191626809e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] 2.706537720000000e+00 -3.799999999110071e-07 -3.333333332552693e-01 PASS