Match comparison for Energy [step 1] (match type 4216)
Commits >
Commit abc749737cc12a5b79d975879ed425be2e62065f >
Input 13-absorption-spin.06-td_spinkick.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -6.136196726297000e+00 | 2.290000000000000e-02 | -6.134127247290875e+00 | 1.381633784263150e-13 | -6.134127247290923e+00 | 1.860733789271762e-13 | PASS |
Checks for this match
- MPI builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
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Detailed information
Reference: -6.136196726297, precision: 0.0229| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | -6.134127247290747e+00 | 2.069479006252983e-03 | 9.037026228178967e-02 | PASS |
| spack_foss-2022a_serial_opt | -6.134127247290747e+00 | 2.069479006252983e-03 | 9.037026228178967e-02 | PASS |
| spack_foss-2022a_serial_min | -6.134127247290747e+00 | 2.069479006252983e-03 | 9.037026228178967e-02 | PASS |
| spack_foss-2022a_serial | -6.134127247290747e+00 | 2.069479006252983e-03 | 9.037026228178967e-02 | PASS |
| foss-2022a_opt | -6.134127247290756e+00 | 2.069479006244102e-03 | 9.037026228140181e-02 | PASS |
| intel-2022b | -6.134127247290791e+00 | 2.069479006209463e-03 | 9.037026227988919e-02 | PASS |
| intel-2022a | -6.134127247290791e+00 | 2.069479006209463e-03 | 9.037026227988919e-02 | PASS |
| cmake_foss_2022a_full_mpi | -6.134127247291048e+00 | 2.069479005951891e-03 | 9.037026226864152e-02 | PASS |
| spack_foss-2022a_serial_omp | -6.134127247290780e+00 | 2.069479006220121e-03 | 9.037026228035462e-02 | PASS |
| eb_fosscuda-2022a | -6.134127247290861e+00 | 2.069479006139296e-03 | 9.037026227682517e-02 | PASS |
| foss-2022a_omp | -6.134127247290798e+00 | 2.069479006202357e-03 | 9.037026227957891e-02 | PASS |
| foss-2022a_ppc | -6.134127247290903e+00 | 2.069479006097552e-03 | 9.037026227500228e-02 | PASS |
| spack_foss-2022a_serial_debug | -6.134127247290747e+00 | 2.069479006252983e-03 | 9.037026228178967e-02 | PASS |
| intel-2022a_omp | -6.134127247290833e+00 | 2.069479006166830e-03 | 9.037026227802751e-02 | PASS |
| intel-2022b_impi | -6.134127247291109e+00 | 2.069479005891495e-03 | 9.037026226600413e-02 | PASS |
| intel-2022a_impi | -6.134127247291109e+00 | 2.069479005891495e-03 | 9.037026226600413e-02 | PASS |
| cmake_foss_2022a_min_serial | -6.134127247290747e+00 | 2.069479006252983e-03 | 9.037026228178967e-02 | PASS |
| eb_fosscuda-2022a_mpi_omp | -6.134127247290919e+00 | 2.069479006081565e-03 | 9.037026227430414e-02 | PASS |
| foss-2022a_mpi_omp | -6.134127247290982e+00 | 2.069479006018504e-03 | 9.037026227155040e-02 | PASS |
| cmake_foss_2022a_min_mpi | -6.134127247291084e+00 | 2.069479005916364e-03 | 9.037026226709012e-02 | PASS |
| eb_foss-2022a | -6.134127247290737e+00 | 2.069479006263641e-03 | 9.037026228225509e-02 | PASS |
| eb_foss-2022b_libxc6 | -6.134127247290737e+00 | 2.069479006263641e-03 | 9.037026228225509e-02 | PASS |
| intel-2022a_omp_impi | -6.134127247291024e+00 | 2.069479005976760e-03 | 9.037026226972750e-02 | PASS |
| eb_foss-2022a_mpi | -6.134127247291054e+00 | 2.069479005946562e-03 | 9.037026226840882e-02 | PASS |
| eb_foss-2022a_debug | -6.134127247290737e+00 | 2.069479006263641e-03 | 9.037026228225509e-02 | PASS |
| eb_foss-2022b_libxc6_mpi | -6.134127247291054e+00 | 2.069479005946562e-03 | 9.037026226840882e-02 | PASS |
| eb_foss-2022a_mpi_debug | -6.134127247291054e+00 | 2.069479005946562e-03 | 9.037026226840882e-02 | PASS |