Match comparison for Hartree energy (match type 28946)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 6.122738752000000e+01 | 3.060000000000000e-07 | 6.122738755434782e+01 | 1.505880090687822e-07 | 6.122738752000000e+01 | 2.499999993688107e-07 | PASS |
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Detailed information
Reference: 61.22738752, precision: 0.000000306| Run | Value | Difference | Relative difference | Status |
| foss-2022a_ppc | 6.122738775000000e+01 | 2.299999977140033e-07 | 7.516339794575270e-01 | PASS |
| foss-2022a_opt | 6.122738740000000e+01 | -1.200000028234172e-07 | -3.921568719719515e-01 | PASS |
| intel-2022a | 6.122738744000000e+01 | -7.999999951380232e-08 | -2.614379069078507e-01 | PASS |
| foss-2022a_omp | 6.122738769000000e+01 | 1.699999998550084e-07 | 5.555555550817266e-01 | PASS |
| intel-2022a_impi | 6.122738738000000e+01 | -1.399999973727972e-07 | -4.575163312836510e-01 | PASS |
| eb_foss-2022a | 6.122738770000000e+01 | 1.800000006824121e-07 | 5.882352963477518e-01 | PASS |
| eb_foss-2022a_debug | 6.122738770000000e+01 | 1.800000006824121e-07 | 5.882352963477518e-01 | PASS |
| eb_foss-2022b_libxc6 | 6.122738752000000e+01 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_foss-2022a_mpi | 6.122738768000000e+01 | 1.599999990276046e-07 | 5.228758138157015e-01 | PASS |
| foss-2022a_mpi_omp | 6.122738761000000e+01 | 9.000000034120603e-08 | 2.941176481738759e-01 | PASS |
| eb_foss-2022b_libxc6_mpi | 6.122738777000000e+01 | 2.499999993688107e-07 | 8.169934619895773e-01 | PASS |
| intel-2022b | 6.122738744000000e+01 | -7.999999951380232e-08 | -2.614379069078507e-01 | PASS |
| eb_foss-2022a_mpi_debug | 6.122738768000000e+01 | 1.599999990276046e-07 | 5.228758138157015e-01 | PASS |
| spack_foss-2022a_serial | 6.122738769000000e+01 | 1.699999998550084e-07 | 5.555555550817266e-01 | PASS |
| intel-2022a_omp | 6.122738727000000e+01 | -2.499999993688107e-07 | -8.169934619895773e-01 | PASS |
| spack_foss-2022a_mpi | 6.122738750000000e+01 | -2.000000165480742e-08 | -6.535948253205039e-02 | PASS |
| spack_foss-2022a_serial_debug | 6.122738769000000e+01 | 1.699999998550084e-07 | 5.555555550817266e-01 | PASS |
| spack_foss-2022a_serial_min | 6.122738769000000e+01 | 1.699999998550084e-07 | 5.555555550817266e-01 | PASS |
| intel-2022b_impi | 6.122738738000000e+01 | -1.399999973727972e-07 | -4.575163312836510e-01 | PASS |
| spack_foss-2022a_serial_omp | 6.122738748000000e+01 | -4.000000330961484e-08 | -1.307189650641008e-01 | PASS |
| spack_foss-2022a_serial_opt | 6.122738751000000e+01 | -1.000000082740371e-08 | -3.267974126602519e-02 | PASS |
| spack_foss-2022a_mpi_omp | 6.122738751000000e+01 | -1.000000082740371e-08 | -3.267974126602519e-02 | PASS |
| intel-2022a_omp_impi | 6.122738727000000e+01 | -2.499999993688107e-07 | -8.169934619895773e-01 | PASS |