Match comparison for Eigenvalues sum (match type 12966)
Commits >
Commit 4eed2c655b9f478fca43a397c5feb863f7436add >
Input 03-sodium_chain.03-ground_state_disp.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -3.455994370000000e+00 | 1.730000000000000e-07 | -3.455994377083333e+00 | 1.567353563291456e-08 | -3.455994370000000e+00 | 2.999999981767587e-08 | PASS |
Checks do not indicate problems with this match.
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Detailed information
Reference: -3.45599437, precision: 0.000000173| Run | Value | Difference | Relative difference | Status |
| eb_foss-2022a_ppc | -3.455994380000000e+00 | -9.999999939225290e-09 | -5.780346785679358e-02 | PASS |
| cmake_foss_2022a_full_serial | -3.455994390000000e+00 | -1.999999987845058e-08 | -1.156069357135872e-01 | PASS |
| cmake_foss_2022a_min_serial | -3.455994390000000e+00 | -1.999999987845058e-08 | -1.156069357135872e-01 | PASS |
| cmake_foss_2022a_full_mpi | -3.455994390000000e+00 | -1.999999987845058e-08 | -1.156069357135872e-01 | PASS |
| eb_fosscuda-2022a | -3.455994380000000e+00 | -9.999999939225290e-09 | -5.780346785679358e-02 | PASS |
| cmake_foss_2022a_min_mpi | -3.455994390000000e+00 | -1.999999987845058e-08 | -1.156069357135872e-01 | PASS |
| eb_foss-2022a_debug | -3.455994400000000e+00 | -2.999999981767587e-08 | -1.734104035703808e-01 | PASS |
| eb_foss-2022b_libxc6 | -3.455994360000000e+00 | 9.999999939225290e-09 | 5.780346785679358e-02 | PASS |
| eb_intel-2022a | -3.455994360000000e+00 | 9.999999939225290e-09 | 5.780346785679358e-02 | PASS |
| eb_foss-2022b_libxc6_mpi | -3.455994360000000e+00 | 9.999999939225290e-09 | 5.780346785679358e-02 | PASS |
| intel-2022b | -3.455994360000000e+00 | 9.999999939225290e-09 | 5.780346785679358e-02 | PASS |
| eb_intel-2022a_omp | -3.455994340000000e+00 | 2.999999981767587e-08 | 1.734104035703808e-01 | PASS |
| eb_foss-2022a_mpi_debug | -3.455994400000000e+00 | -2.999999981767587e-08 | -1.734104035703808e-01 | PASS |
| eb_intel-2022a_impi | -3.455994360000000e+00 | 9.999999939225290e-09 | 5.780346785679358e-02 | PASS |
| spack_foss-2022a_serial | -3.455994390000000e+00 | -1.999999987845058e-08 | -1.156069357135872e-01 | PASS |
| spack_foss-2022a_mpi | -3.455994390000000e+00 | -1.999999987845058e-08 | -1.156069357135872e-01 | PASS |
| spack_foss-2022a_cuda_mpi_omp | -3.455994370000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_serial_min | -3.455994390000000e+00 | -1.999999987845058e-08 | -1.156069357135872e-01 | PASS |
| intel-2022b_impi | -3.455994360000000e+00 | 9.999999939225290e-09 | 5.780346785679358e-02 | PASS |
| spack_foss-2022a_serial_debug | -3.455994390000000e+00 | -1.999999987845058e-08 | -1.156069357135872e-01 | PASS |
| spack_foss-2022a_serial_omp | -3.455994370000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| spack_foss-2022a_serial_opt | -3.455994390000000e+00 | -1.999999987845058e-08 | -1.156069357135872e-01 | PASS |
| spack_foss-2022a_mpi_omp | -3.455994370000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |
| eb_intel-2022a_omp_impi | -3.455994370000000e+00 | 0.000000000000000e+00 | 0.000000000000000e+00 | PASS |