Match comparison for Total energy (match type 28508)

Commits > Commit 15b914f6cf8a906b04634cf1151edac44a3f54fa > Input 01-nio.01-U5-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.471481281000000e+02 1.110000000000000e-05 -2.471481275944444e+02 2.751116046844548e-06 -2.471481280350000e+02 5.145000002926281e-06 PASS
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Detailed information

Reference: -247.1481281, precision: 0.0000111
Run Value Difference Relative difference Status
cmake_foss_2022a_full_serial -2.471481273100000e+02 7.900000014160469e-07 7.117117129874295e-02 PASS
spack_foss-2022a_serial_min -2.471481273100000e+02 7.900000014160469e-07 7.117117129874295e-02 PASS
spack_foss-2023a_serial_min -2.471481267700000e+02 1.330000003463283e-06 1.198198201318273e-01 PASS
spack_foss-2023a_serial -2.471481267700000e+02 1.330000003463283e-06 1.198198201318273e-01 PASS
spack_foss-2022a_serial -2.471481273100000e+02 7.900000014160469e-07 7.117117129874295e-02 PASS
spack_foss-2022a_ppc -2.471481282200000e+02 -1.199999815071351e-07 -1.081080914478694e-02 PASS
cmake_foss_2022a_min_serial -2.471481273100000e+02 7.900000014160469e-07 7.117117129874295e-02 PASS
cmake_foss_2022a_min_mpi -2.471481303500000e+02 -2.249999994319296e-06 -2.027027021909276e-01 PASS
spack_foss-2023a_mpi_min -2.471481236400000e+02 4.460000013750687e-06 4.018018030406024e-01 PASS
spack_foss-2022a_mpi_min -2.471481303500000e+02 -2.249999994319296e-06 -2.027027021909276e-01 PASS
cmake_foss_2022a_full_mpi -2.471481303500000e+02 -2.249999994319296e-06 -2.027027021909276e-01 PASS
spack_foss-2023a_serial_debug -2.471481267700000e+02 1.330000003463283e-06 1.198198201318273e-01 PASS
spack_foss-2023a_mpi_opt -2.471481236400000e+02 4.460000013750687e-06 4.018018030406024e-01 PASS
spack_foss-2022a_mpi -2.471481303500000e+02 -2.249999994319296e-06 -2.027027021909276e-01 PASS
spack_foss-2023a_mpi -2.471481236400000e+02 4.460000013750687e-06 4.018018030406024e-01 PASS
spack_foss-2022a_cuda_serial -2.471481331800000e+02 -5.079999993995443e-06 -4.576576571167066e-01 PASS
spack_foss-2022a_cuda_mpi_omp -2.471481228900000e+02 5.210000011857119e-06 4.693693704375783e-01 PASS
spack_foss-2023a_mpi_debug -2.471481236400000e+02 4.460000013750687e-06 4.018018030406024e-01 PASS
spack_foss-2023a_mpi_omp -2.471481289400000e+02 -8.399999842367833e-07 -7.567567425556607e-02 PASS
spack_foss-2023a_serial_opt -2.471481267700000e+02 1.330000003463283e-06 1.198198201318273e-01 PASS
spack_foss-2023b_serial -2.471481267700000e+02 1.330000003463283e-06 1.198198201318273e-01 PASS
spack_foss-2023a_serial_omp -2.471481331600000e+02 -5.059999978129781e-06 -4.558558538855658e-01 PASS
spack_intel-2023a_serial -2.471481286500000e+02 -5.499999815583578e-07 -4.954954788814035e-02 PASS
spack_intel-2022a_serial_omp -2.471481246200000e+02 3.480000003719397e-06 3.135135138485943e-01 PASS
spack_intel-2023a_serial_omp -2.471481275900000e+02 5.100000066704524e-07 4.594594654688761e-02 PASS
spack_intel-2023a_impi -2.471481278100000e+02 2.900000026784255e-07 2.612612636742572e-02 PASS
spack_intel-2022a_impi_omp -2.471481309400000e+02 -2.839999979187269e-06 -2.558558539808350e-01 PASS