Match comparison for Kinetic energy (match type 12056)

Commits > Commit 6816b153d33f61198d1ef96fd0f4ab733dba1073 > Input 14-fullerene_unpacked.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
2.253708492800000e+02 1.270000000000000e-05 2.253708496952941e+02 1.941355252091511e-06 2.253708509400000e+02 2.770000008922580e-06 PASS

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Detailed information

Reference: 225.37084928000002, precision: 0.0000127
Run Value Difference Relative difference Status
foss-2022a_ppc 2.253708485200000e+02 -7.600000060392631e-07 -5.984252016057189e-02 PASS
spack_foss-2022a_serial 2.253708537100000e+02 4.429999989952194e-06 3.488188968466294e-01 PASS
foss-2022a_opt 2.253708484300000e+02 -8.500000205913238e-07 -6.692913547963179e-02 PASS
spack_foss-2022a_serial_min 2.253708537100000e+02 4.429999989952194e-06 3.488188968466294e-01 PASS
eb_foss-2022a 2.253708498300000e+02 5.499999815583578e-07 4.330708516207542e-02 PASS
foss-2022a_omp 2.253708489100000e+02 -3.700000092976552e-07 -2.913385899981537e-02 PASS
spack_foss-2022a_serial_debug 2.253708537100000e+02 4.429999989952194e-06 3.488188968466294e-01 PASS
eb_foss-2022b_libxc6 2.253708500400000e+02 7.599999776175537e-07 5.984251792264202e-02 PASS
eb_fosscuda-2022a 2.253708481700000e+02 -1.110000027892966e-06 -8.740157699944610e-02 PASS
spack_foss-2022a_serial_omp 2.253708483700000e+02 -9.100000113448914e-07 -7.165354420038515e-02 PASS
eb_foss-2022a_debug 2.253708498300000e+02 5.499999815583578e-07 4.330708516207542e-02 PASS
spack_foss-2022a_serial_opt 2.253708482700000e+02 -1.010000005408074e-06 -7.952755948095069e-02 PASS
eb_foss-2022a_mpi 2.253708482200000e+02 -1.060000016650520e-06 -8.346456824019839e-02 PASS
eb_foss-2022b_libxc6_mpi 2.253708492300000e+02 -5.000001124244591e-08 -3.937008759247709e-03 PASS
eb_fosscuda-2022a_mpi_omp 2.253708485500000e+02 -7.300000106624793e-07 -5.748031580019522e-02 PASS
eb_foss-2022a_mpi_debug 2.253708486500000e+02 -6.300000165992969e-07 -4.960630051962968e-02 PASS
foss-2022a_mpi_omp 2.253708486700000e+02 -6.100000291553442e-07 -4.803149835868852e-02 PASS