Match comparison for Total energy (match type 28508)

Commits > Commit b6caf805fea115365f1246dd8a44b3bc3b7dd03a > Input 01-nio.01-U5-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.471481281000000e+02 1.240000000000000e-05 -2.471481279118750e+02 2.042768398783608e-06 -2.471481272900000e+02 3.649999996468978e-06 PASS

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Detailed information

Reference: -247.1481281, precision: 0.0000124
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min -2.471481273100000e+02 7.900000014160469e-07 6.370967753355217e-02 PASS
spack_foss-2023a_serial_min -2.471481267700000e+02 1.330000003463283e-06 1.072580647954261e-01 PASS
spack_foss-2022a_serial_opt -2.471481273100000e+02 7.900000014160469e-07 6.370967753355217e-02 PASS
spack_foss-2022a_serial -2.471481273100000e+02 7.900000014160469e-07 6.370967753355217e-02 PASS
spack_foss-2022a_ppc -2.471481282200000e+02 -1.199999815071351e-07 -9.677417863478636e-03 PASS
spack_foss-2022a_mpi_min -2.471481303500000e+02 -2.249999994319296e-06 -1.814516124451045e-01 PASS
spack_foss-2023a_mpi_min -2.471481236400000e+02 4.460000013750687e-06 3.596774204637651e-01 PASS
spack_foss-2022a_serial_debug -2.471481273100000e+02 7.900000014160469e-07 6.370967753355217e-02 PASS
spack_foss-2022a_mpi_opt -2.471481303500000e+02 -2.249999994319296e-06 -1.814516124451045e-01 PASS
spack_intel-2022a_serial_omp -2.471481246200000e+02 3.480000003719397e-06 2.806451615902739e-01 PASS
spack_foss-2022a_mpi -2.471481303500000e+02 -2.249999994319296e-06 -1.814516124451045e-01 PASS
spack_foss-2022a_cuda_serial -2.471481267300000e+02 1.370000006772898e-06 1.104838715139434e-01 PASS
spack_intel-2023a_impi -2.471481278100000e+02 2.900000026784255e-07 2.338709699019561e-02 PASS
spack_foss-2022a_mpi_debug -2.471481303500000e+02 -2.249999994319296e-06 -1.814516124451045e-01 PASS
spack_foss-2022a_cuda_mpi_omp -2.471481272200000e+02 8.800000159681076e-07 7.096774322323449e-02 PASS
spack_intel-2022a_impi_omp -2.471481309400000e+02 -2.839999979187269e-06 -2.290322563860701e-01 PASS