Match comparison for Kinetic energy (match type 12056)

Commits > Commit c7ac96946c926bee5c46ca4221093c1f60753f5a > Input 14-fullerene_unpacked.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
2.253708492800000e+02 1.270000000000000e-05 2.253708492629630e+02 2.931777131094092e-06 2.253708466750000e+02 7.034999995880753e-06 PASS

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Detailed information

Reference: 225.37084928000002, precision: 0.0000127
Run Value Difference Relative difference Status
spack_foss-2022a_ppc 2.253708477800000e+02 -1.500000024634573e-06 -1.181102381602026e-01 PASS
spack_foss-2023a_mpi 2.253708483800000e+02 -9.000000034120603e-07 -7.086614200094964e-02 PASS
cmake_foss_2022a_full_mpi 2.253708396400000e+02 -9.640000001809312e-06 -7.590551182527018e-01 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
spack_foss-2023a_mpi_debug 2.253708482700000e+02 -1.010000005408074e-06 -7.952755948095069e-02 PASS
cmake_foss_2022a_min_mpi 2.253708491000000e+02 -1.800000291041215e-07 -1.417323063811980e-02 PASS
spack_foss-2022a_serial 2.253708537100000e+02 4.429999989952194e-06 3.488188968466294e-01 PASS
spack_foss-2022a_serial_min 2.253708537100000e+02 4.429999989952194e-06 3.488188968466294e-01 PASS
spack_foss-2022a_mpi 2.253708488100000e+02 -4.700000033608376e-07 -3.700787428038091e-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_mpi_opt 2.253708481600000e+02 -1.120000007404087e-06 -8.818897696095175e-02 PASS
spack_foss-2023a_serial 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_debug 2.253708537100000e+02 4.429999989952194e-06 3.488188968466294e-01 PASS
spack_foss-2022a_cuda_mpi_omp 2.253708485600000e+02 -7.200000027296483e-07 -5.669291360075970e-02 PASS
spack_foss-2023a_serial_opt 2.253708482700000e+02 -1.010000005408074e-06 -7.952755948095069e-02 PASS
spack_foss-2023a_serial_omp 2.253708482400000e+02 -1.040000029206567e-06 -8.188976607925724e-02 PASS
spack_foss-2022a_cuda_serial 2.253708480400000e+02 -1.240000017332932e-06 -9.763779664038832e-02 PASS
spack_foss-2023a_mpi_omp 2.253708483100000e+02 -9.700000020984589e-07 -7.637795292113850e-02 PASS
spack_foss-2023b_serial 2.253708537100000e+02 4.429999989952194e-06 3.488188968466294e-01 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-2023a_serial_omp 2.253708475300000e+02 -1.750000024003384e-06 -1.377952774805814e-01 PASS
spack_intel-2023a_impi 2.253708484300000e+02 -8.500000205913238e-07 -6.692913547963179e-02 PASS
spack_intel-2022a_impi_omp 2.253708482400000e+02 -1.040000029206567e-06 -8.188976607925724e-02 PASS