Match comparison for MVORB HSE06 Fock Correlation (match type 23349)

Commits > Commit 155f01ef7d18124a1050c3611747e8f8b44bbe31 > Input 03-xc.mvorb_hse06_fock.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.072237000000000e-01 2.180000000000000e-06 -2.007462259375000e-01 3.605508654665151e-02 -1.036128350000000e-01 1.036128350000000e-01 FAIL

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Detailed information

Reference: -0.2072237, precision: 0.00000218
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
foss-serial-min: [foss2022a-serial] -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
foss-serial-min: [foss2023b-serial] -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
foss-serial-min: [foss2023a-serial] -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
intel_autotools: [intel2023a-serial] -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
foss-serial-full: [foss2023a-serial] -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
foss-opt-full: [foss2023a-serial] -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
foss-serial-full: [foss2023b-serial] -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
foss-ppc: [foss2022a-serial] -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
intel_omp_autotools: [intel2023a-serial] -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
foss-serial-debug: [foss2023a-serial] -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
intel_omp_autotools: [intel2022a-serial] -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
foss-omp-full: [foss2023a-serial] -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
foss-mpi-full: [foss2023a-mpi] -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
foss-mpi-debug: [foss2023a-mpi] -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
foss-mpi-min: [foss2023a-mpi] -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
foss-mpi-min: [foss2022a-mpi] -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
cuda-serial: [foss2022a-cuda-mpi] 0.000000000000000e+00 2.072237000000000e-01 9.505674311926606e+04 FAIL
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -2.072256700000000e-01 -1.969999999990035e-06 -9.036697247660713e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS