Match comparison for Total energy (match type 27129)

Commits > Commit ea6affb390844fd1d159151b43e705a091215c1a > Input 02-ACBN0.01-nio.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.870867399400000e+02 4.710000000000000e-05 -2.870867404725926e+02 1.481454720854595e-06 -2.870867400000000e+02 2.809999983810485e-06 PASS
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Detailed information

Reference: -287.08673994000003, precision: 0.0000471
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min -2.870867380100000e+02 1.930000053107506e-06 4.097664656279205e-02 PASS
spack_foss-2023a_serial_opt -2.870867412200000e+02 -1.279999992220837e-06 -2.717622064163136e-02 PASS
spack_foss-2023a_serial -2.870867412200000e+02 -1.279999992220837e-06 -2.717622064163136e-02 PASS
spack_foss-2023a_serial_min -2.870867412200000e+02 -1.279999992220837e-06 -2.717622064163136e-02 PASS
spack_foss-2023b_serial -2.870867412200000e+02 -1.279999992220837e-06 -2.717622064163136e-02 PASS
spack_foss-2022a_serial -2.870867380100000e+02 1.930000053107506e-06 4.097664656279205e-02 PASS
spack_foss-2022a_mpi_min -2.870867411200000e+02 -1.179999969735945e-06 -2.505307791371434e-02 PASS
spack_foss-2022a_ppc -2.870867410600000e+02 -1.119999978982378e-06 -2.377919275971078e-02 PASS
spack_foss-2023a_mpi_min -2.870867413800000e+02 -1.439999948615878e-06 -3.057324731668530e-02 PASS
spack_foss-2023a_serial_omp -2.870867397700000e+02 1.700000211712904e-07 3.609342275398947e-03 PASS
spack_foss-2022a_mpi -2.870867411200000e+02 -1.179999969735945e-06 -2.505307791371434e-02 PASS
spack_foss-2023a_mpi -2.870867413800000e+02 -1.439999948615878e-06 -3.057324731668530e-02 PASS
spack_foss-2023a_serial_debug -2.870867412200000e+02 -1.279999992220837e-06 -2.717622064163136e-02 PASS
spack_foss-2023a_mpi_debug -2.870867413800000e+02 -1.439999948615878e-06 -3.057324731668530e-02 PASS
spack_foss-2023a_mpi_omp -2.870867401300000e+02 -1.899999801935337e-07 -4.033969855489038e-03 PASS
cmake_foss_2022a_full_serial -2.870867421700000e+02 -2.229999950031925e-06 -4.734607112594320e-02 PASS
cmake_foss_2022a_min_serial -2.870867380100000e+02 1.930000053107506e-06 4.097664656279205e-02 PASS
cmake_foss_2022a_min_mpi -2.870867411200000e+02 -1.179999969735945e-06 -2.505307791371434e-02 PASS
cmake_foss_2022a_full_mpi -2.870867387200000e+02 1.220000001467270e-06 2.590233548762780e-02 PASS
spack_intel-2023a_serial -2.870867410200000e+02 -1.079999947251054e-06 -2.292993518579731e-02 PASS
spack_intel-2022a_impi_omp -2.870867371900000e+02 2.750000021478627e-06 5.838641234561841e-02 PASS
spack_intel-2022a_serial_omp -2.870867423100000e+02 -2.369999947404722e-06 -5.031847022090705e-02 PASS
spack_intel-2023a_serial_omp -2.870867393000000e+02 6.400000529538374e-07 1.358811152768232e-02 PASS
spack_intel-2023a_impi -2.870867410700000e+02 -1.129999986915209e-06 -2.399150715318915e-02 PASS
spack_foss-2023a_mpi_opt -2.870867413800000e+02 -1.439999948615878e-06 -3.057324731668530e-02 PASS
spack_foss-2022a_cuda_mpi_omp -2.870867382000000e+02 1.740000016070553e-06 3.694267550043637e-02 PASS
spack_foss-2022a_cuda_serial -2.870867428100000e+02 -2.869999946142343e-06 -6.093418144675888e-02 PASS