Match comparison for X Force Atom 1 [step 10] (match type 24691)
Commits >
Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 >
Input 22-td_move_ions_periodic.02-td.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -5.427048672230912e+00 | 3.450000000000000e-10 | -5.427048672544629e+00 | 1.162826739325314e-14 | -5.427048672544629e+00 | 2.131628207280301e-14 | PASS |
Checks for this match
- Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Detailed information
Reference: -5.427048672230912, precision: 0.000000000345| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | -5.427048672544613e+00 | -3.137010651244054e-10 | -9.092784496359578e-01 | PASS |
| spack_foss-2022a_serial_min | -5.427048672544613e+00 | -3.137010651244054e-10 | -9.092784496359578e-01 | PASS |
| foss-2022a_ppc | -5.427048672544608e+00 | -3.136957360538872e-10 | -9.092630030547456e-01 | PASS |
| spack_foss-2022a_serial_opt | -5.427048672544613e+00 | -3.137010651244054e-10 | -9.092784496359578e-01 | PASS |
| spack_foss-2022a_serial | -5.427048672544613e+00 | -3.137010651244054e-10 | -9.092784496359578e-01 | PASS |
| foss-2022a_opt | -5.427048672544633e+00 | -3.137214932280585e-10 | -9.093376615306045e-01 | PASS |
| intel-2022b | -5.427048672544650e+00 | -3.137383686180328e-10 | -9.093865757044430e-01 | PASS |
| intel-2022a | -5.427048672544650e+00 | -3.137383686180328e-10 | -9.093865757044430e-01 | PASS |
| spack_foss-2022a_serial_omp | -5.427048672544636e+00 | -3.137241577633176e-10 | -9.093453848212105e-01 | PASS |
| cmake_foss_2022a_full_mpi | -5.427048672544639e+00 | -3.137268222985767e-10 | -9.093531081118166e-01 | PASS |
| spack_foss-2022a_serial_debug | -5.427048672544613e+00 | -3.137010651244054e-10 | -9.092784496359578e-01 | PASS |
| foss-2022a_omp | -5.427048672544636e+00 | -3.137241577633176e-10 | -9.093453848212105e-01 | PASS |
| intel-2022a_omp | -5.427048672544639e+00 | -3.137268222985767e-10 | -9.093531081118166e-01 | PASS |
| intel-2022b_impi | -5.427048672544628e+00 | -3.137161641575403e-10 | -9.093222149493922e-01 | PASS |
| intel-2022a_impi | -5.427048672544628e+00 | -3.137161641575403e-10 | -9.093222149493922e-01 | PASS |
| eb_fosscuda-2022a_mpi_omp | -5.427048672544645e+00 | -3.137330395475146e-10 | -9.093711291232308e-01 | PASS |
| eb_fosscuda-2022a | -5.427048672544631e+00 | -3.137188286927994e-10 | -9.093299382399984e-01 | PASS |
| cmake_foss_2022a_min_serial | -5.427048672544613e+00 | -3.137010651244054e-10 | -9.092784496359578e-01 | PASS |
| foss-2022a_mpi_omp | -5.427048672544622e+00 | -3.137099469086024e-10 | -9.093041939379781e-01 | PASS |
| cmake_foss_2022a_min_mpi | -5.427048672544622e+00 | -3.137099469086024e-10 | -9.093041939379781e-01 | PASS |
| eb_foss-2022a | -5.427048672544633e+00 | -3.137214932280585e-10 | -9.093376615306045e-01 | PASS |
| eb_foss-2022b_libxc6 | -5.427048672544633e+00 | -3.137214932280585e-10 | -9.093376615306045e-01 | PASS |
| eb_foss-2022a_debug | -5.427048672544633e+00 | -3.137214932280585e-10 | -9.093376615306045e-01 | PASS |
| intel-2022a_omp_impi | -5.427048672544633e+00 | -3.137214932280585e-10 | -9.093376615306045e-01 | PASS |
| eb_foss-2022a_mpi | -5.427048672544628e+00 | -3.137161641575403e-10 | -9.093222149493922e-01 | PASS |
| eb_foss-2022b_libxc6_mpi | -5.427048672544628e+00 | -3.137161641575403e-10 | -9.093222149493922e-01 | PASS |
| eb_foss-2022a_mpi_debug | -5.427048672544628e+00 | -3.137161641575403e-10 | -9.093222149493922e-01 | PASS |