Match comparison for Energy [step 100] (match type 26975)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -4.097479152162752e+00 | 1.450000000000000e-10 | -4.113523716297980e+00 | 5.672610039599233e-02 | -4.205779959855954e+00 | 1.083008077829657e-01 | FAIL |
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: -4.097479152162752, precision: 0.000000000145| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | -4.097479152201958e+00 | -3.920685998082263e-11 | -2.703921377987767e-01 | PASS |
| foss-2022a_ppc | -4.097479152168106e+00 | -5.353939513952355e-12 | -3.692372078587831e-02 | PASS |
| spack_foss-2022a_serial_min | -4.097479152201958e+00 | -3.920685998082263e-11 | -2.703921377987767e-01 | PASS |
| spack_foss-2022a_serial_opt | -4.097479152201958e+00 | -3.920685998082263e-11 | -2.703921377987767e-01 | PASS |
| spack_foss-2022a_serial | -4.097479152201958e+00 | -3.920685998082263e-11 | -2.703921377987767e-01 | PASS |
| foss-2022a_opt | -4.097479152247552e+00 | -8.480061097770886e-11 | -5.848317998462680e-01 | PASS |
| intel-2022b | -4.097479152178725e+00 | -1.597300069988705e-11 | -1.101586255164624e-01 | PASS |
| intel-2022a | -4.097479152178725e+00 | -1.597300069988705e-11 | -1.101586255164624e-01 | PASS |
| cmake_foss_2022a_full_mpi | -4.097479152230727e+00 | -6.797584717332938e-11 | -4.687989460229613e-01 | PASS |
| spack_foss-2022a_serial_omp | -4.097479152183924e+00 | -2.117239716881159e-11 | -1.460165321987006e-01 | PASS |
| spack_foss-2022a_serial_debug | -4.097479152201958e+00 | -3.920685998082263e-11 | -2.703921377987767e-01 | PASS |
| foss-2022a_omp | -4.097479152072989e+00 | 8.976286380857346e-11 | 6.190542331625756e-01 | PASS |
| eb_fosscuda-2022a | -4.314080767559790e+00 | -2.166016153970380e-01 | -1.493804244117504e+09 | FAIL |
| intel-2022a_omp | -4.097479152180141e+00 | -1.738964527930875e-11 | -1.199285881331638e-01 | PASS |
| intel-2022b_impi | -4.097479152171615e+00 | -8.863132450187550e-12 | -6.112505138060380e-02 | PASS |
| intel-2022a_impi | -4.097479152171615e+00 | -8.863132450187550e-12 | -6.112505138060380e-02 | PASS |
| eb_fosscuda-2022a_mpi_omp | -4.314080767638920e+00 | -2.166016154761685e-01 | -1.493804244663231e+09 | FAIL |
| cmake_foss_2022a_min_serial | -4.097479152201958e+00 | -3.920685998082263e-11 | -2.703921377987767e-01 | PASS |
| foss-2022a_mpi_omp | -4.097479152167475e+00 | -4.723332835965266e-12 | -3.257470921355356e-02 | PASS |
| cmake_foss_2022a_min_mpi | -4.097479152230727e+00 | -6.797584717332938e-11 | -4.687989460229613e-01 | PASS |
| eb_foss-2022a | -4.097479152247552e+00 | -8.480061097770886e-11 | -5.848317998462680e-01 | PASS |
| eb_foss-2022b_libxc6 | -4.097479152148361e+00 | 1.439026675598143e-11 | 9.924321900676848e-02 | PASS |
| eb_foss-2022a_debug | -4.097479152247552e+00 | -8.480061097770886e-11 | -5.848317998462680e-01 | PASS |
| intel-2022a_omp_impi | -4.097479152158395e+00 | 4.356515148629114e-12 | 3.004493205951114e-02 | PASS |
| eb_foss-2022a_mpi | -4.097479152169752e+00 | -7.000622304076387e-12 | -4.828015382121647e-02 | PASS |
| eb_foss-2022b_libxc6_mpi | -4.097479152311300e+00 | -1.485487288732656e-10 | -1.024473992229418e+00 | FAIL |
| eb_foss-2022a_mpi_debug | -4.097479152169752e+00 | -7.000622304076387e-12 | -4.828015382121647e-02 | PASS |