Match comparison for Kinetic energy (match type 12056)

Commits > Commit 85779d3dd9ec6e18544835020e079bae8c405b87 > Input 14-fullerene_unpacked.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
2.253708492800000e+02 1.270000000000000e-05 2.253708497173077e+02 2.240400994030939e-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-2023a_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-2023a_serial 2.253708537100000e+02 4.429999989952194e-06 3.488188968466294e-01 PASS
spack_foss-2023b_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_cuda_serial 2.253708480400000e+02 -1.240000017332932e-06 -9.763779664038832e-02 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-2023a_serial_omp 2.253708482400000e+02 -1.040000029206567e-06 -8.188976607925724e-02 PASS
spack_foss-2023a_mpi_opt 2.253708487500000e+02 -5.300000225361146e-07 -4.173228523906414e-02 PASS
spack_foss-2023a_serial_debug 2.253708537100000e+02 4.429999989952194e-06 3.488188968466294e-01 PASS
spack_foss-2022a_mpi 2.253708486800000e+02 -6.000000212225132e-07 -4.724409615925301e-02 PASS
spack_foss-2023a_mpi 2.253708488000000e+02 -4.800000112936686e-07 -3.779527647981643e-02 PASS
spack_foss-2023a_mpi_debug 2.253708486100000e+02 -6.700000199089118e-07 -5.275590707944187e-02 PASS
spack_foss-2022a_cuda_mpi_omp 2.253708482400000e+02 -1.040000029206567e-06 -8.188976607925724e-02 PASS
spack_foss-2023a_mpi_omp 2.253708485400000e+02 -7.400000185953104e-07 -5.826771799963074e-02 PASS
cmake_foss_2022a_min_serial 2.253708482700000e+02 -1.010000005408074e-06 -7.952755948095069e-02 PASS
cmake_foss_2022a_full_serial 2.253708482700000e+02 -1.010000005408074e-06 -7.952755948095069e-02 PASS
cmake_foss_2022a_min_mpi 2.253708483200000e+02 -9.600000225873373e-07 -7.559055295963285e-02 PASS
cmake_foss_2022a_full_mpi 2.253708494700000e+02 1.899999801935337e-07 1.496062836169557e-02 PASS
spack_intel-2023a_serial 2.253708504300000e+02 1.149999974359162e-06 9.055117908339855e-02 PASS
spack_intel-2022a_serial_omp 2.253708484100000e+02 -8.700000080352766e-07 -6.850393764057296e-02 PASS
spack_intel-2022a_impi_omp 2.253708480600000e+02 -1.220000029888979e-06 -9.606299447944716e-02 PASS
spack_intel-2023a_impi 2.253708485100000e+02 -7.700000139720942e-07 -6.062992236000742e-02 PASS