Match comparison for External energy (match type 12951)
Commits >
Commit 4eed2c655b9f478fca43a397c5feb863f7436add >
Input 03-sodium_chain.01-ground_state.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| 8.030990720000000e+00 | 4.020000000000000e-07 | 8.030990657500000e+00 | 4.474464534627290e-08 | 8.030990670000001e+00 | 4.999999969612645e-08 | PASS |
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Detailed information
Reference: 8.03099072, precision: 0.000000402| Run | Value | Difference | Relative difference | Status |
| eb_foss-2022a_ppc | 8.030990689999999e+00 | -3.000000070585429e-08 | -7.462686742749823e-02 | PASS |
| cmake_foss_2022a_full_serial | 8.030990620000001e+00 | -9.999999939225290e-08 | -2.487562173936639e-01 | PASS |
| cmake_foss_2022a_min_serial | 8.030990620000001e+00 | -9.999999939225290e-08 | -2.487562173936639e-01 | PASS |
| cmake_foss_2022a_full_mpi | 8.030990620000001e+00 | -9.999999939225290e-08 | -2.487562173936639e-01 | PASS |
| eb_fosscuda-2022a | 8.030990700000000e+00 | -1.999999987845058e-08 | -4.975124347873278e-02 | PASS |
| cmake_foss_2022a_min_mpi | 8.030990620000001e+00 | -9.999999939225290e-08 | -2.487562173936639e-01 | PASS |
| eb_foss-2022a_debug | 8.030990709999999e+00 | -1.000000082740371e-08 | -2.487562394876545e-02 | PASS |
| eb_foss-2022b_libxc6 | 8.030990709999999e+00 | -1.000000082740371e-08 | -2.487562394876545e-02 | PASS |
| eb_intel-2022a | 8.030990620000001e+00 | -9.999999939225290e-08 | -2.487562173936639e-01 | PASS |
| eb_foss-2022b_libxc6_mpi | 8.030990709999999e+00 | -1.000000082740371e-08 | -2.487562394876545e-02 | PASS |
| intel-2022b | 8.030990620000001e+00 | -9.999999939225290e-08 | -2.487562173936639e-01 | PASS |
| eb_intel-2022a_omp | 8.030990709999999e+00 | -1.000000082740371e-08 | -2.487562394876545e-02 | PASS |
| eb_foss-2022a_mpi_debug | 8.030990709999999e+00 | -1.000000082740371e-08 | -2.487562394876545e-02 | PASS |
| eb_intel-2022a_impi | 8.030990620000001e+00 | -9.999999939225290e-08 | -2.487562173936639e-01 | PASS |
| spack_foss-2022a_serial | 8.030990620000001e+00 | -9.999999939225290e-08 | -2.487562173936639e-01 | PASS |
| spack_foss-2022a_mpi | 8.030990620000001e+00 | -9.999999939225290e-08 | -2.487562173936639e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | 8.030990720000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_serial_min | 8.030990620000001e+00 | -9.999999939225290e-08 | -2.487562173936639e-01 | PASS |
| intel-2022b_impi | 8.030990620000001e+00 | -9.999999939225290e-08 | -2.487562173936639e-01 | PASS |
| spack_foss-2022a_serial_debug | 8.030990620000001e+00 | -9.999999939225290e-08 | -2.487562173936639e-01 | PASS |
| spack_foss-2022a_serial_omp | 8.030990720000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_serial_opt | 8.030990620000001e+00 | -9.999999939225290e-08 | -2.487562173936639e-01 | PASS |
| spack_foss-2022a_mpi_omp | 8.030990720000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_intel-2022a_omp_impi | 8.030990620000001e+00 | -9.999999939225290e-08 | -2.487562173936639e-01 | PASS |