Match comparison for Kinetic energy (match type 12056)

Commits > Commit 22a7b3628f7ddff53691f80b422d9224cf7a2498 > Input 14-fullerene_unpacked.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
2.253708492800000e+02 1.270000000000000e-05 2.253708498566667e+02 2.291670911266268e-06 2.253708506200000e+02 3.090000006977789e-06 PASS

Checks for this match

  • Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Get updated match line Get updated match line with fixed reference

Detailed information

Reference: 225.37084928000002, precision: 0.0000127
Run Value Difference Relative difference Status
spack_foss-2023a_serial_min 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-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-2023b_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-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-2023a_serial_omp 2.253708482400000e+02 -1.040000029206567e-06 -8.188976607925724e-02 PASS
spack_foss-2023a_serial_debug 2.253708537100000e+02 4.429999989952194e-06 3.488188968466294e-01 PASS
spack_foss-2022a_cuda_serial 2.253708480400000e+02 -1.240000017332932e-06 -9.763779664038832e-02 PASS
spack_foss-2023a_mpi_opt 2.253708479800000e+02 -1.300000008086499e-06 -1.023622053611417e-01 PASS
spack_foss-2022a_mpi 2.253708511500000e+02 1.869999977088810e-06 1.472440926841583e-01 PASS
spack_foss-2023a_mpi 2.253708477300000e+02 -1.550000007455310e-06 -1.220472446815205e-01 PASS
cmake_foss_2022a_full_mpi 2.253708483700000e+02 -9.100000113448914e-07 -7.165354420038515e-02 PASS
spack_foss-2022a_cuda_mpi_omp 2.253708490400000e+02 -2.400000198576890e-07 -1.889763935887315e-02 PASS
spack_foss-2023a_mpi_debug 2.253708493800000e+02 9.999999406318238e-08 7.874015280565541e-03 PASS
spack_foss-2023a_mpi_omp 2.253708485300000e+02 -7.500000265281415e-07 -5.905512019906625e-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 2.253708497500000e+02 4.699999749391282e-07 3.700787204245103e-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-2023a_serial_omp 2.253708475300000e+02 -1.750000024003384e-06 -1.377952774805814e-01 PASS
spack_intel-2023a_impi 2.253708480100000e+02 -1.270000012709716e-06 -1.000000010007650e-01 PASS
spack_intel-2022a_impi_omp 2.253708519900000e+02 2.709999989747303e-06 2.133858259643545e-01 PASS