Match comparison for Hartree energy (match type 27132)
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 8.788829173000001e+01 | 1.410000000000000e-05 | 8.788829147307692e+01 | 6.156095746133700e-07 | 8.788829177000000e+01 | 1.740000001859698e-06 | PASS |
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Detailed information
Reference: 87.88829173, precision: 0.0000141| Run | Value | Difference | Relative difference | Status |
| foss-2022a_ppc | 8.788829122000000e+01 | -5.100000066704524e-07 | -3.617021323903918e-02 | PASS |
| cmake_foss_2022a_full_serial | 8.788829027000000e+01 | -1.460000007114104e-06 | -1.035460997953265e-01 | PASS |
| cmake_foss_2022a_min_serial | 8.788829179000000e+01 | 5.999999075356754e-08 | 4.255318493160819e-03 | PASS |
| cmake_foss_2022a_full_mpi | 8.788829351000000e+01 | 1.779999990958459e-06 | 1.262411341105290e-01 | PASS |
| eb_fosscuda-2022a | 8.788829223000000e+01 | 4.999999987376214e-07 | 3.546099281827102e-02 | PASS |
| cmake_foss_2022a_min_mpi | 8.788829133000000e+01 | -4.000000046744390e-07 | -2.836879465776163e-02 | PASS |
| eb_foss-2022a | 8.788829133999999e+01 | -3.900000109524626e-07 | -2.765957524485550e-02 | PASS |
| eb_foss-2022a_debug | 8.788829133999999e+01 | -3.900000109524626e-07 | -2.765957524485550e-02 | PASS |
| eb_foss-2022b_libxc6 | 8.788829142000000e+01 | -3.100000043332329e-07 | -2.198581591015836e-02 | PASS |
| eb_foss-2022a_mpi | 8.788829171000000e+01 | -2.000000165480742e-08 | -1.418439833674285e-03 | PASS |
| foss-2022a_opt | 8.788829133999999e+01 | -3.900000109524626e-07 | -2.765957524485550e-02 | PASS |
| foss-2022a_omp | 8.788829142000000e+01 | -3.100000043332329e-07 | -2.198581591015836e-02 | PASS |
| eb_foss-2022b_libxc6_mpi | 8.788829142000000e+01 | -3.100000043332329e-07 | -2.198581591015836e-02 | PASS |
| intel-2022a | 8.788829105000001e+01 | -6.799999994200334e-07 | -4.822695031347755e-02 | PASS |
| eb_foss-2022a_mpi_debug | 8.788829171000000e+01 | -2.000000165480742e-08 | -1.418439833674285e-03 | PASS |
| intel-2022b | 8.788829105000001e+01 | -6.799999994200334e-07 | -4.822695031347755e-02 | PASS |
| eb_fosscuda-2022a_mpi_omp | 8.788829148000001e+01 | -2.499999993688107e-07 | -1.773049640913551e-02 | PASS |
| spack_foss-2022a_serial | 8.788829179000000e+01 | 5.999999075356754e-08 | 4.255318493160819e-03 | PASS |
| intel-2022a_omp | 8.788829104000000e+01 | -6.900000073528645e-07 | -4.893617073424571e-02 | PASS |
| intel-2022a_impi | 8.788829144000000e+01 | -2.900000026784255e-07 | -2.056737607648408e-02 | PASS |
| spack_foss-2022a_serial_min | 8.788829179000000e+01 | 5.999999075356754e-08 | 4.255318493160819e-03 | PASS |
| foss-2022a_mpi_omp | 8.788829002999999e+01 | -1.700000012760938e-06 | -1.205673767915559e-01 | PASS |
| intel-2022b_impi | 8.788829144000000e+01 | -2.900000026784255e-07 | -2.056737607648408e-02 | PASS |
| spack_foss-2022a_serial_debug | 8.788829179000000e+01 | 5.999999075356754e-08 | 4.255318493160819e-03 | PASS |
| spack_foss-2022a_serial_omp | 8.788829207000001e+01 | 3.399999997100167e-07 | 2.411347515673877e-02 | PASS |
| intel-2022a_omp_impi | 8.788829128000000e+01 | -4.500000017060302e-07 | -3.191489373801632e-02 | PASS |