Match comparison for M-solvent int. energy @ t=0 (match type 12046)
Commits >
Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 >
Input 32-tdpcm_methane.03-td_prop_eom.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -1.495587625573000e-02 | 1.000000000000000e-04 | -1.501578001382876e-02 | 8.754915713575727e-14 | -1.501578001386188e-02 | 1.933488091854230e-13 | PASS |
Checks for this match
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Detailed information
Reference: -0.01495587625573, precision: 0.0001| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | -1.501578001388605e-02 | -5.990375815604666e-05 | -5.990375815604666e-01 | PASS |
| spack_foss-2022a_serial_min | -1.501578001391021e-02 | -5.990375818021483e-05 | -5.990375818021483e-01 | PASS |
| foss-2022a_ppc | -1.501578001374104e-02 | -5.990375801103592e-05 | -5.990375801103592e-01 | PASS |
| spack_foss-2022a_serial_opt | -1.501578001388605e-02 | -5.990375815604666e-05 | -5.990375815604666e-01 | PASS |
| spack_foss-2022a_serial | -1.501578001391021e-02 | -5.990375818021483e-05 | -5.990375818021483e-01 | PASS |
| foss-2022a_opt | -1.501578001405523e-02 | -5.990375832522730e-05 | -5.990375832522730e-01 | PASS |
| intel-2022b | -1.501578001376520e-02 | -5.990375803520409e-05 | -5.990375803520409e-01 | PASS |
| intel-2022a | -1.501578001376520e-02 | -5.990375803520409e-05 | -5.990375803520409e-01 | PASS |
| spack_foss-2022a_serial_omp | -1.501578001376520e-02 | -5.990375803520409e-05 | -5.990375803520409e-01 | PASS |
| cmake_foss_2022a_full_mpi | -1.501578001398272e-02 | -5.990375825272107e-05 | -5.990375825272106e-01 | PASS |
| spack_foss-2022a_serial_debug | -1.501578001391021e-02 | -5.990375818021483e-05 | -5.990375818021483e-01 | PASS |
| foss-2022a_omp | -1.501578001381354e-02 | -5.990375808354043e-05 | -5.990375808354043e-01 | PASS |
| intel-2022a_omp | -1.501578001371687e-02 | -5.990375798686776e-05 | -5.990375798686776e-01 | PASS |
| intel-2022b_impi | -1.501578001376520e-02 | -5.990375803520409e-05 | -5.990375803520409e-01 | PASS |
| intel-2022a_impi | -1.501578001376520e-02 | -5.990375803520409e-05 | -5.990375803520409e-01 | PASS |
| eb_fosscuda-2022a_mpi_omp | -1.501578001366853e-02 | -5.990375793852969e-05 | -5.990375793852968e-01 | PASS |
| eb_fosscuda-2022a | -1.501578001376520e-02 | -5.990375803520409e-05 | -5.990375803520409e-01 | PASS |
| cmake_foss_2022a_min_serial | -1.501578001388605e-02 | -5.990375815604666e-05 | -5.990375815604666e-01 | PASS |
| foss-2022a_mpi_omp | -1.501578001383771e-02 | -5.990375810771033e-05 | -5.990375810771033e-01 | PASS |
| cmake_foss_2022a_min_mpi | -1.501578001383771e-02 | -5.990375810771033e-05 | -5.990375810771033e-01 | PASS |
| eb_foss-2022a | -1.501578001383771e-02 | -5.990375810771033e-05 | -5.990375810771033e-01 | PASS |
| eb_foss-2022b_libxc6 | -1.501578001391021e-02 | -5.990375818021483e-05 | -5.990375818021483e-01 | PASS |
| eb_foss-2022a_debug | -1.501578001383771e-02 | -5.990375810771033e-05 | -5.990375810771033e-01 | PASS |
| intel-2022a_omp_impi | -1.501578001369270e-02 | -5.990375796269785e-05 | -5.990375796269785e-01 | PASS |
| eb_foss-2022a_mpi | -1.501578001378937e-02 | -5.990375805937226e-05 | -5.990375805937226e-01 | PASS |
| eb_foss-2022b_libxc6_mpi | -1.501578001388605e-02 | -5.990375815604666e-05 | -5.990375815604666e-01 | PASS |
| eb_foss-2022a_mpi_debug | -1.501578001378937e-02 | -5.990375805937226e-05 | -5.990375805937226e-01 | PASS |