Match comparison for Kinetic energy (match type 12056)

Commits > Commit 119356330ffc33ec037b7259f31bc868121af1f1 > Input 14-fullerene_unpacked.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
2.253708492800000e+02 1.270000000000000e-05 2.253708497706250e+02 2.293415765776756e-06 2.253708507450000e+02 2.965000007293384e-06 PASS

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Detailed information

Reference: 225.37084928000002, precision: 0.0000127
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min 2.253708537100000e+02 4.429999989952194e-06 3.488188968466294e-01 PASS
spack_foss-2023a_serial_min 2.253708537100000e+02 4.429999989952194e-06 3.488188968466294e-01 PASS
spack_foss-2022a_serial_opt 2.253708482700000e+02 -1.010000005408074e-06 -7.952755948095069e-02 PASS
spack_foss-2022a_serial 2.253708537100000e+02 4.429999989952194e-06 3.488188968466294e-01 PASS
spack_foss-2022a_ppc 2.253708477800000e+02 -1.500000024634573e-06 -1.181102381602026e-01 PASS
spack_foss-2022a_mpi_min 2.253708483500000e+02 -9.300000272105535e-07 -7.322834859925619e-02 PASS
spack_foss-2023a_mpi_min 2.253708483500000e+02 -9.300000272105535e-07 -7.322834859925619e-02 PASS
spack_foss-2022a_mpi_opt 2.253708487400000e+02 -5.400000020472362e-07 -4.251968520056978e-02 PASS
spack_foss-2022a_serial_debug 2.253708537100000e+02 4.429999989952194e-06 3.488188968466294e-01 PASS
spack_intel-2022a_serial_omp 2.253708484100000e+02 -8.700000080352766e-07 -6.850393764057296e-02 PASS
spack_foss-2022a_mpi 2.253708490700000e+02 -2.100000244809053e-07 -1.653543499849648e-02 PASS
spack_intel-2023a_impi 2.253708484500000e+02 -8.300000047256617e-07 -6.535433108076076e-02 PASS
spack_foss-2022a_mpi_debug 2.253708484600000e+02 -8.200000252145401e-07 -6.456693111925513e-02 PASS
spack_foss-2022a_cuda_serial 2.253708480400000e+02 -1.240000017332932e-06 -9.763779664038832e-02 PASS
spack_foss-2022a_cuda_mpi_omp 2.253708489000000e+02 -3.800000172304863e-07 -2.992126119925089e-02 PASS
spack_intel-2022a_impi_omp 2.253708486700000e+02 -6.100000291553442e-07 -4.803149835868852e-02 PASS