Match comparison for gga_x_pbe_sol Int[n*v_xc] (match type 12361)

Commits > Commit 3f3300a09a325083399ad405019c399609c6d1c2 > Input 03-xc.gga_x_pbe_sol.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.892937500000000e-01 4.540000000000000e-06 -3.771320534375000e-01 6.773491637677552e-02 -1.946489400000000e-01 1.946489400000000e-01 FAIL

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Detailed information

Reference: -0.38929375, precision: 0.00000454
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -3.892978600000000e-01 -4.110000000001612e-06 -9.052863436126900e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -3.892978600000000e-01 -4.110000000001612e-06 -9.052863436126900e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -3.892978800000000e-01 -4.129999999991085e-06 -9.096916299539836e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -3.892978800000000e-01 -4.129999999991085e-06 -9.096916299539836e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -3.892978600000000e-01 -4.110000000001612e-06 -9.052863436126900e-01 PASS
foss-serial-min: [foss2023a-serial] -3.892978600000000e-01 -4.110000000001612e-06 -9.052863436126900e-01 PASS
foss-serial-min: [foss2022a-serial] -3.892978600000000e-01 -4.110000000001612e-06 -9.052863436126900e-01 PASS
foss-opt-full: [foss2023a-serial] -3.892978600000000e-01 -4.110000000001612e-06 -9.052863436126900e-01 PASS
foss-serial-min: [foss2023b-serial] -3.892978600000000e-01 -4.110000000001612e-06 -9.052863436126900e-01 PASS
foss-serial-full: [foss2023b-serial] -3.892978600000000e-01 -4.110000000001612e-06 -9.052863436126900e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -3.892978600000000e-01 -4.110000000001612e-06 -9.052863436126900e-01 PASS
intel_autotools: [intel2023a-serial] -3.892978600000000e-01 -4.110000000001612e-06 -9.052863436126900e-01 PASS
foss-serial-full: [foss2023a-serial] -3.892978600000000e-01 -4.110000000001612e-06 -9.052863436126900e-01 PASS
foss-ppc: [foss2022a-serial] -3.892978600000000e-01 -4.110000000001612e-06 -9.052863436126900e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -3.892978800000000e-01 -4.129999999991085e-06 -9.096916299539836e-01 PASS
foss-serial-debug: [foss2023a-serial] -3.892978600000000e-01 -4.110000000001612e-06 -9.052863436126900e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -3.892978800000000e-01 -4.129999999991085e-06 -9.096916299539836e-01 PASS
intel_omp_autotools: [intel2022a-serial] -3.892978600000000e-01 -4.110000000001612e-06 -9.052863436126900e-01 PASS
intel_omp_autotools: [intel2023a-serial] -3.892978600000000e-01 -4.110000000001612e-06 -9.052863436126900e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] -3.892978800000000e-01 -4.129999999991085e-06 -9.096916299539836e-01 PASS
foss-omp-full: [foss2023a-serial] -3.892978600000000e-01 -4.110000000001612e-06 -9.052863436126900e-01 PASS
foss-mpi-full: [foss2023a-mpi] -3.892978800000000e-01 -4.129999999991085e-06 -9.096916299539836e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -3.892978800000000e-01 -4.129999999991085e-06 -9.096916299539836e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -3.892978800000000e-01 -4.129999999991085e-06 -9.096916299539836e-01 PASS
foss-mpi-min: [foss2022a-mpi] -3.892978800000000e-01 -4.129999999991085e-06 -9.096916299539836e-01 PASS
foss-mpi-min: [foss2023a-mpi] -3.892978800000000e-01 -4.129999999991085e-06 -9.096916299539836e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -3.892978800000000e-01 -4.129999999991085e-06 -9.096916299539836e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -3.892978800000000e-01 -4.129999999991085e-06 -9.096916299539836e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] -3.892978800000000e-01 -4.129999999991085e-06 -9.096916299539836e-01 PASS
cuda-serial: [foss2022a-cuda-mpi] 0.000000000000000e+00 3.892937500000000e-01 8.574752202643172e+04 FAIL
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -3.892896300000000e-01 4.119999999996349e-06 9.074889867833368e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -3.892978800000000e-01 -4.129999999991085e-06 -9.096916299539836e-01 PASS