Match comparison for Hartree energy (match type 31761)
General information
| Reference |
Precision |
Mean |
Standard deviation |
Midpoint |
Half width |
Status |
| 3.610174400000000e+00 |
3.570000000000000e-05 |
3.610155790000000e+00 |
0.000000000000000e+00 |
3.610155790000000e+00 |
0.000000000000000e+00 |
PASS |
Checks for this match
- Mid point of values far away from reference. Recentering may be necessary.
Detailed information
Reference: 3.6101744, precision: 0.0000357
| Run |
Value |
Difference |
Relative difference |
Status |
| foss-cmake-zen4: [foss2023a-serial, foss-min] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss-cmake-zen4: [foss2023a-serial, foss-full] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss-serial-full: [foss2023b-serial] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss-serial-debug: [foss2023a-serial] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss-ppc: [foss2022a-serial] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss-mpi-min: [foss2022a-mpi] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss-serial-full: [foss2023a-serial] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss-serial-min: [foss2023a-serial] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss-mpi-omp-full: [foss2023a-mpi] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss-mpi-min: [foss2023a-mpi] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss-omp-full: [foss2023a-serial] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss-serial-min: [foss2022a-serial] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss_cmake: [foss2022a-serial, foss-full] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss_cmake: [foss2022a-serial, foss-min] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss-mpi-full: [foss2023a-mpi] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss-mpi-opt-full: [foss2023a-mpi] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss-serial-min: [foss2023b-serial] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |
| foss-opt-full: [foss2023a-serial] |
3.610155790000000e+00 |
-1.861000000014101e-05 |
-5.212885154101125e-01 |
PASS |