Match comparison for RDMFT highest occupation number (match type 11927)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 1.946806716954000e+00 | 1.000000000000000e-03 | 1.946759800657000e+00 | 1.235706739379852e-05 | 1.946741189470500e+00 | 2.237976649999140e-05 | PASS |
Checks for this match
- GPU builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: 1.946806716954, precision: 0.001| Run | Value | Difference | Relative difference | Status |
| eb_foss-2022a_ppc | 1.946763533963000e+00 | -4.318299099992373e-05 | -4.318299099992373e-02 | PASS |
| cmake_foss_2022a_full_serial | 1.946763522491000e+00 | -4.319446299994034e-05 | -4.319446299994034e-02 | PASS |
| cmake_foss_2022a_min_serial | 1.946763522491000e+00 | -4.319446299994034e-05 | -4.319446299994034e-02 | PASS |
| cmake_foss_2022a_full_mpi | 1.946763516786000e+00 | -4.320016799996829e-05 | -4.320016799996829e-02 | PASS |
| eb_fosscuda-2022a | 1.946718809704000e+00 | -8.790724999996335e-05 | -8.790724999996335e-02 | PASS |
| cmake_foss_2022a_min_mpi | 1.946763522264000e+00 | -4.319468999991471e-05 | -4.319468999991471e-02 | PASS |
| eb_foss-2022a_debug | 1.946763539568000e+00 | -4.317738599990406e-05 | -4.317738599990406e-02 | PASS |
| eb_foss-2022b_libxc6 | 1.946763501103000e+00 | -4.321585099997804e-05 | -4.321585099997804e-02 | PASS |
| eb_intel-2022a | 1.946763509244000e+00 | -4.320770999988177e-05 | -4.320770999988177e-02 | PASS |
| eb_foss-2022b_libxc6_mpi | 1.946763494839000e+00 | -4.322211499996342e-05 | -4.322211499996342e-02 | PASS |
| intel-2022b | 1.946763509244000e+00 | -4.320770999988177e-05 | -4.320770999988177e-02 | PASS |
| eb_intel-2022a_omp | 1.946763535866000e+00 | -4.318108799994391e-05 | -4.318108799994391e-02 | PASS |
| eb_foss-2022a_mpi_debug | 1.946763532741000e+00 | -4.318421299998043e-05 | -4.318421299998043e-02 | PASS |
| eb_intel-2022a_impi | 1.946763534304000e+00 | -4.318265000002874e-05 | -4.318265000002874e-02 | PASS |
| spack_foss-2022a_serial | 1.946763569237000e+00 | -4.314771699998055e-05 | -4.314771699998055e-02 | PASS |
| spack_foss-2022a_mpi | 1.946763519295000e+00 | -4.319765900007155e-05 | -4.319765900007155e-02 | PASS |
| spack_foss-2022a_cuda_mpi_omp | 1.946718824205000e+00 | -8.789274900000699e-05 | -8.789274900000699e-02 | PASS |
| spack_foss-2022a_serial_min | 1.946763569237000e+00 | -4.314771699998055e-05 | -4.314771699998055e-02 | PASS |
| intel-2022b_impi | 1.946763534304000e+00 | -4.318265000002874e-05 | -4.318265000002874e-02 | PASS |
| spack_foss-2022a_serial_debug | 1.946763569237000e+00 | -4.314771699998055e-05 | -4.314771699998055e-02 | PASS |
| spack_foss-2022a_serial_omp | 1.946763514003000e+00 | -4.320295100002092e-05 | -4.320295100002092e-02 | PASS |
| spack_foss-2022a_serial_opt | 1.946763500403000e+00 | -4.321655100003596e-05 | -4.321655100003596e-02 | PASS |
| spack_foss-2022a_mpi_omp | 1.946763517177000e+00 | -4.319977700006916e-05 | -4.319977700006916e-02 | PASS |
| eb_intel-2022a_omp_impi | 1.946763514062000e+00 | -4.320289199988281e-05 | -4.320289199988281e-02 | PASS |