Match comparison for Hartree energy (match type 23860)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 6.510589381000000e+01 | 5.000000000000000e-06 | 6.510589409416667e+01 | 6.016153016189395e-07 | 6.510589411500000e+01 | 9.449999964772360e-07 | PASS |
Checks for this match
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Detailed information
Reference: 65.10589381, precision: 0.000005| Run | Value | Difference | Relative difference | Status |
| eb_foss-2022a_ppc | 6.510589446000000e+01 | 6.500000040432496e-07 | 1.300000008086499e-01 | PASS |
| cmake_foss_2022a_full_serial | 6.510589317000000e+01 | -6.399999961104186e-07 | -1.279999992220837e-01 | PASS |
| cmake_foss_2022a_min_serial | 6.510589317000000e+01 | -6.399999961104186e-07 | -1.279999992220837e-01 | PASS |
| cmake_foss_2022a_full_mpi | 6.510589443000001e+01 | 6.200000086664659e-07 | 1.240000017332932e-01 | PASS |
| eb_fosscuda-2022a | 6.510589458000000e+01 | 7.699999997612395e-07 | 1.539999999522479e-01 | PASS |
| cmake_foss_2022a_min_mpi | 6.510589443000001e+01 | 6.200000086664659e-07 | 1.240000017332932e-01 | PASS |
| eb_foss-2022a_debug | 6.510589437000000e+01 | 5.600000037020436e-07 | 1.120000007404087e-01 | PASS |
| eb_foss-2022b_libxc6 | 6.510589414000000e+01 | 3.300000059880404e-07 | 6.600000119760807e-02 | PASS |
| eb_intel-2022a | 6.510589455000000e+01 | 7.400000043844557e-07 | 1.480000008768911e-01 | PASS |
| eb_foss-2022b_libxc6_mpi | 6.510589417000000e+01 | 3.600000013648241e-07 | 7.200000027296483e-02 | PASS |
| intel-2022b | 6.510589455000000e+01 | 7.400000043844557e-07 | 1.480000008768911e-01 | PASS |
| eb_intel-2022a_omp | 6.510589421000000e+01 | 4.000000046744390e-07 | 8.000000093488779e-02 | PASS |
| eb_foss-2022a_mpi_debug | 6.510589444000000e+01 | 6.300000023884422e-07 | 1.260000004776884e-01 | PASS |
| eb_intel-2022a_impi | 6.510589505999999e+01 | 1.249999996844053e-06 | 2.499999993688106e-01 | PASS |
| spack_foss-2022a_serial | 6.510589317000000e+01 | -6.399999961104186e-07 | -1.279999992220837e-01 | PASS |
| spack_foss-2022a_mpi | 6.510589443000001e+01 | 6.200000086664659e-07 | 1.240000017332932e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | 6.510589396000000e+01 | 1.500000053056283e-07 | 3.000000106112565e-02 | PASS |
| spack_foss-2022a_serial_min | 6.510589317000000e+01 | -6.399999961104186e-07 | -1.279999992220837e-01 | PASS |
| intel-2022b_impi | 6.510589505999999e+01 | 1.249999996844053e-06 | 2.499999993688106e-01 | PASS |
| spack_foss-2022a_serial_debug | 6.510589317000000e+01 | -6.399999961104186e-07 | -1.279999992220837e-01 | PASS |
| spack_foss-2022a_serial_omp | 6.510589458000000e+01 | 7.699999997612395e-07 | 1.539999999522479e-01 | PASS |
| spack_foss-2022a_serial_opt | 6.510589317000000e+01 | -6.399999961104186e-07 | -1.279999992220837e-01 | PASS |
| spack_foss-2022a_mpi_omp | 6.510589404000000e+01 | 2.299999977140033e-07 | 4.599999954280064e-02 | PASS |
| eb_intel-2022a_omp_impi | 6.510589378000000e+01 | -2.999999537678377e-08 | -5.999999075356754e-03 | PASS |