Match comparison for Exchange energy (match type 24299)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -3.164498139000000e+01 | 1.500000000000000e-06 | -3.164498186125000e+01 | 4.935864704225165e-07 | -3.164498171000000e+01 | 9.199999997377972e-07 | PASS |
Checks for this match
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: -31.644981389999998, precision: 0.0000015| Run | Value | Difference | Relative difference | Status |
| eb_foss-2022a_ppc | -3.164498160000000e+01 | -2.100000031646232e-07 | -1.400000021097488e-01 | PASS |
| cmake_foss_2022a_full_serial | -3.164498187000000e+01 | -4.800000006355276e-07 | -3.200000004236851e-01 | PASS |
| cmake_foss_2022a_min_serial | -3.164498187000000e+01 | -4.800000006355276e-07 | -3.200000004236851e-01 | PASS |
| cmake_foss_2022a_full_mpi | -3.164498263000000e+01 | -1.240000003122077e-06 | -8.266666687480513e-01 | PASS |
| eb_fosscuda-2022a | -3.164498087000000e+01 | 5.199999968397151e-07 | 3.466666645598100e-01 | PASS |
| cmake_foss_2022a_min_mpi | -3.164498189000000e+01 | -5.000000022903350e-07 | -3.333333348602234e-01 | PASS |
| eb_foss-2022a_debug | -3.164498154000000e+01 | -1.500000017529146e-07 | -1.000000011686097e-01 | PASS |
| eb_foss-2022b_libxc6 | -3.164498193000000e+01 | -5.400000020472362e-07 | -3.600000013648241e-01 | PASS |
| eb_intel-2022a | -3.164498079000000e+01 | 5.999999963535174e-07 | 3.999999975690116e-01 | PASS |
| eb_foss-2022b_libxc6_mpi | -3.164498209000000e+01 | -7.000000010748408e-07 | -4.666666673832272e-01 | PASS |
| intel-2022b | -3.164498079000000e+01 | 5.999999963535174e-07 | 3.999999975690116e-01 | PASS |
| eb_intel-2022a_omp | -3.164498177000000e+01 | -3.800000030196315e-07 | -2.533333353464211e-01 | PASS |
| eb_foss-2022a_mpi_debug | -3.164498222000000e+01 | -8.300000011729480e-07 | -5.533333341152987e-01 | PASS |
| eb_intel-2022a_impi | -3.164498217000000e+01 | -7.800000005886432e-07 | -5.200000003924288e-01 | PASS |
| spack_foss-2022a_serial | -3.164498187000000e+01 | -4.800000006355276e-07 | -3.200000004236851e-01 | PASS |
| spack_foss-2022a_mpi | -3.164498263000000e+01 | -1.240000003122077e-06 | -8.266666687480513e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -3.164498145000000e+01 | -6.000000141170858e-08 | -4.000000094113906e-02 | PASS |
| spack_foss-2022a_serial_min | -3.164498187000000e+01 | -4.800000006355276e-07 | -3.200000004236851e-01 | PASS |
| intel-2022b_impi | -3.164498217000000e+01 | -7.800000005886432e-07 | -5.200000003924288e-01 | PASS |
| spack_foss-2022a_serial_debug | -3.164498187000000e+01 | -4.800000006355276e-07 | -3.200000004236851e-01 | PASS |
| spack_foss-2022a_serial_omp | -3.164498215000000e+01 | -7.600000024865494e-07 | -5.066666683243662e-01 | PASS |
| spack_foss-2022a_serial_opt | -3.164498187000000e+01 | -4.800000006355276e-07 | -3.200000004236851e-01 | PASS |
| spack_foss-2022a_mpi_omp | -3.164498252000000e+01 | -1.130000001126064e-06 | -7.533333340840423e-01 | PASS |
| eb_intel-2022a_omp_impi | -3.164498224000000e+01 | -8.500000028277555e-07 | -5.666666685518370e-01 | PASS |