Match comparison for Kinetic energy (match type 12056)

Commits > Commit abc749737cc12a5b79d975879ed425be2e62065f > Input 14-fullerene_unpacked.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
2.253708492800000e+02 1.270000000000000e-05 2.253708493325926e+02 1.674160027660087e-06 2.253708508600000e+02 2.850000001330955e-06 PASS

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Detailed information

Reference: 225.37084928000002, precision: 0.0000127
Run Value Difference Relative difference Status
cmake_foss_2022a_full_serial 2.253708482700000e+02 -1.010000005408074e-06 -7.952755948095069e-02 PASS
spack_foss-2022a_serial_opt 2.253708482700000e+02 -1.010000005408074e-06 -7.952755948095069e-02 PASS
spack_foss-2022a_serial_min 2.253708537100000e+02 4.429999989952194e-06 3.488188968466294e-01 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
intel-2022b 2.253708500600000e+02 7.799999934832158e-07 6.141732232151306e-02 PASS
intel-2022a 2.253708500600000e+02 7.799999934832158e-07 6.141732232151306e-02 PASS
cmake_foss_2022a_full_mpi 2.253708480500000e+02 -1.230000009400101e-06 -9.685039444095281e-02 PASS
spack_foss-2022a_serial_omp 2.253708483700000e+02 -9.100000113448914e-07 -7.165354420038515e-02 PASS
eb_fosscuda-2022a 2.253708481700000e+02 -1.110000027892966e-06 -8.740157699944610e-02 PASS
foss-2022a_omp 2.253708489100000e+02 -3.700000092976552e-07 -2.913385899981537e-02 PASS
foss-2022a_ppc 2.253708485200000e+02 -7.600000060392631e-07 -5.984252016057189e-02 PASS
spack_foss-2022a_serial_debug 2.253708537100000e+02 4.429999989952194e-06 3.488188968466294e-01 PASS
intel-2022a_omp 2.253708493700000e+02 8.999998613035132e-08 7.086613081130025e-03 PASS
intel-2022b_impi 2.253708487400000e+02 -5.400000020472362e-07 -4.251968520056978e-02 PASS
intel-2022a_impi 2.253708480100000e+02 -1.270000012709716e-06 -1.000000010007650e-01 PASS
cmake_foss_2022a_min_serial 2.253708482700000e+02 -1.010000005408074e-06 -7.952755948095069e-02 PASS
eb_fosscuda-2022a_mpi_omp 2.253708485500000e+02 -7.300000106624793e-07 -5.748031580019522e-02 PASS
foss-2022a_mpi_omp 2.253708480800000e+02 -1.200000014023317e-06 -9.448819008057613e-02 PASS
cmake_foss_2022a_min_mpi 2.253708490100000e+02 -2.700000152344728e-07 -2.125984371924983e-02 PASS
eb_foss-2022a 2.253708498300000e+02 5.499999815583578e-07 4.330708516207542e-02 PASS
eb_foss-2022b_libxc6 2.253708500400000e+02 7.599999776175537e-07 5.984251792264202e-02 PASS
intel-2022a_omp_impi 2.253708485400000e+02 -7.400000185953104e-07 -5.826771799963074e-02 PASS
eb_foss-2022a_mpi 2.253708483600000e+02 -9.200000192777225e-07 -7.244094639982067e-02 PASS
eb_foss-2022a_debug 2.253708498300000e+02 5.499999815583578e-07 4.330708516207542e-02 PASS
eb_foss-2022b_libxc6_mpi 2.253708485900000e+02 -6.900000073528645e-07 -5.433070924038303e-02 PASS
eb_foss-2022a_mpi_debug 2.253708485200000e+02 -7.600000060392631e-07 -5.984252016057189e-02 PASS