Match comparison for Hartree energy (match type 28370)

Commits > Commit b6caf805fea115365f1246dd8a44b3bc3b7dd03a > Input 10-intersite.02-silicon.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
1.729242832000000e+01 1.900000000000000e-06 1.729242814411764e+01 3.084316841185958e-07 1.729242834000000e+01 5.400000002708794e-07 PASS

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Detailed information

Reference: 17.29242832, precision: 0.0000019
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min 1.729242799000000e+01 -3.299999988826130e-07 -1.736842099382174e-01 PASS
spack_foss-2023a_serial_min 1.729242799000000e+01 -3.299999988826130e-07 -1.736842099382174e-01 PASS
spack_foss-2022a_serial_opt 1.729242799000000e+01 -3.299999988826130e-07 -1.736842099382174e-01 PASS
spack_foss-2022a_serial 1.729242799000000e+01 -3.299999988826130e-07 -1.736842099382174e-01 PASS
spack_foss-2022a_ppc 1.729242838000000e+01 6.000000141170858e-08 3.157894811142557e-02 PASS
spack_foss-2022a_mpi_min 1.729242799000000e+01 -3.299999988826130e-07 -1.736842099382174e-01 PASS
spack_foss-2023a_mpi_min 1.729242799000000e+01 -3.299999988826130e-07 -1.736842099382174e-01 PASS
spack_foss-2022a_serial_debug 1.729242799000000e+01 -3.299999988826130e-07 -1.736842099382174e-01 PASS
spack_foss-2022a_mpi_opt 1.729242799000000e+01 -3.299999988826130e-07 -1.736842099382174e-01 PASS
spack_intel-2022a_serial_omp 1.729242834000000e+01 2.000000165480742e-08 1.052631666042496e-02 PASS
spack_foss-2022a_mpi 1.729242799000000e+01 -3.299999988826130e-07 -1.736842099382174e-01 PASS
spack_foss-2022a_cuda_serial 1.729242888000000e+01 5.600000001493299e-07 2.947368421838579e-01 PASS
spack_intel-2023a_impi 1.729242780000000e+01 -5.200000003924288e-07 -2.736842107328573e-01 PASS
spack_foss-2022a_mpi_debug 1.729242799000000e+01 -3.299999988826130e-07 -1.736842099382174e-01 PASS
spack_foss-2022a_cuda_mpi_omp 1.729242888000000e+01 5.600000001493299e-07 2.947368421838579e-01 PASS
spack_intel-2022a_impi_omp 1.729242834000000e+01 2.000000165480742e-08 1.052631666042496e-02 PASS
spack_foss-2022a_valgrind 1.729242793000000e+01 -3.900000002943216e-07 -2.052631580496429e-01 PASS