Match comparison for Hartree energy (match type 28510)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 4.641776690000000e+01 | 7.890000000000001e-06 | 4.641777086117646e+01 | 2.412025953664264e-06 | 4.641777012500000e+01 | 3.474999999752981e-06 | PASS |
Checks for this match
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Detailed information
Reference: 46.417766900000004, precision: 0.00000789| Run | Value | Difference | Relative difference | Status |
| foss-2022a_ppc | 4.641776776000000e+01 | 8.599999929970181e-07 | 1.089987316853001e-01 | PASS |
| spack_foss-2022a_serial | 4.641777268000000e+01 | 5.779999995070284e-06 | 7.325728764347634e-01 | PASS |
| foss-2022a_opt | 4.641777360000000e+01 | 6.699999993031724e-06 | 8.491761714869105e-01 | PASS |
| spack_foss-2022a_serial_min | 4.641777268000000e+01 | 5.779999995070284e-06 | 7.325728764347634e-01 | PASS |
| eb_foss-2022a | 4.641777360000000e+01 | 6.699999993031724e-06 | 8.491761714869105e-01 | PASS |
| foss-2022a_omp | 4.641776745000000e+01 | 5.499999957692125e-07 | 6.970849122550221e-02 | PASS |
| spack_foss-2022a_serial_debug | 4.641777268000000e+01 | 5.779999995070284e-06 | 7.325728764347634e-01 | PASS |
| eb_foss-2022b_libxc6 | 4.641777127000000e+01 | 4.369999999198626e-06 | 5.538656526233999e-01 | PASS |
| eb_fosscuda-2022a | 4.641777018000000e+01 | 3.279999994276750e-06 | 4.157160955990811e-01 | PASS |
| spack_foss-2022a_serial_omp | 4.641777231000000e+01 | 5.409999992878056e-06 | 6.856780726081186e-01 | PASS |
| eb_foss-2022a_debug | 4.641777360000000e+01 | 6.699999993031724e-06 | 8.491761714869105e-01 | PASS |
| spack_foss-2022a_serial_opt | 4.641777268000000e+01 | 5.779999995070284e-06 | 7.325728764347634e-01 | PASS |
| eb_foss-2022a_mpi | 4.641776792000000e+01 | 1.019999999130050e-06 | 1.292775664296641e-01 | PASS |
| eb_foss-2022b_libxc6_mpi | 4.641776665000000e+01 | -2.500000064742380e-07 | -3.168567889407326e-02 | PASS |
| eb_fosscuda-2022a_mpi_omp | 4.641777227000000e+01 | 5.369999996673869e-06 | 6.806083645974484e-01 | PASS |
| eb_foss-2022a_mpi_debug | 4.641776792000000e+01 | 1.019999999130050e-06 | 1.292775664296641e-01 | PASS |
| foss-2022a_mpi_omp | 4.641776939000000e+01 | 2.489999992860703e-06 | 3.155893527073134e-01 | PASS |