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

Commits > Commit a4341ac9f169107ec4cef5019cc6269df7c401ac > Input 03-xc.mvorb_hse06_fock.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.072237000000000e-01 2.180000000000000e-06 -2.072220707407407e-01 9.971846514455447e-07 -2.072236850000000e-01 1.984999999996018e-06 PASS

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Detailed information

Reference: -0.2072237, precision: 0.00000218
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
spack_foss-2023a_serial_min -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
spack_foss-2023a_serial -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
spack_foss-2023a_serial_opt -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
spack_foss-2022a_serial -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
spack_foss-2023b_serial -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
spack_foss-2022a_ppc -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
spack_foss-2022a_mpi_min -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
spack_foss-2023a_mpi_min -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
spack_foss-2023a_serial_debug -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
spack_foss-2023a_serial_omp -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
spack_foss-2022a_cuda_serial -2.072255000000000e-01 -1.799999999996249e-06 -8.256880733927748e-01 PASS
spack_foss-2023a_mpi_opt -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
spack_foss-2022a_mpi -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
spack_foss-2023a_mpi -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
cmake_foss_2022a_full_mpi -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
spack_foss-2022a_cuda_mpi_omp -2.072256700000000e-01 -1.969999999990035e-06 -9.036697247660713e-01 PASS
spack_foss-2023a_mpi_debug -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
spack_foss-2023a_mpi_omp -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
cmake_foss_2022a_min_serial -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
cmake_foss_2022a_full_serial -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
cmake_foss_2022a_min_mpi -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
spack_intel-2023a_serial -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
spack_intel-2022a_serial_omp -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
spack_intel-2023a_serial_omp -2.072218600000000e-01 1.840000000002950e-06 8.440366972490598e-01 PASS
spack_intel-2023a_impi -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS
spack_intel-2022a_impi_omp -2.072217000000000e-01 2.000000000002000e-06 9.174311926614680e-01 PASS