Match comparison for Exchange energy (match type 30348)
General information
| Reference |
Precision |
Mean |
Standard deviation |
Midpoint |
Half width |
Status |
| -3.446109045000000e+00 |
8.700000000000000e-06 |
-3.446102158260870e+00 |
4.639963659222836e-07 |
-3.446102105000000e+00 |
9.649999999084002e-07 |
PASS |
Checks for this match
- OpenMP builders have different values.
- Mid point of values far away from reference. Recentering may be necessary.
Detailed information
Reference: -3.446109045, precision: 0.0000087
| Run |
Value |
Difference |
Relative difference |
Status |
| foss-cmake-zen4: [foss2023a-serial, foss-min] |
-3.446102600000000e+00 |
6.444999999910550e-06 |
7.408045976908678e-01 |
PASS |
| foss-cmake-zen4: [foss2023a-serial, foss-full] |
-3.446102600000000e+00 |
6.444999999910550e-06 |
7.408045976908678e-01 |
PASS |
| intel_omp_autotools: [intel2023a-serial] |
-3.446101140000000e+00 |
7.904999999919227e-06 |
9.086206896458882e-01 |
PASS |
| intel_autotools: [intel2023a-serial] |
-3.446103070000000e+00 |
5.975000000102426e-06 |
6.867816092071755e-01 |
PASS |
| intel_omp_autotools: [intel2022a-serial] |
-3.446101140000000e+00 |
7.904999999919227e-06 |
9.086206896458882e-01 |
PASS |
| foss-serial-full: [foss2023b-serial] |
-3.446102290000000e+00 |
6.755000000246980e-06 |
7.764367816375839e-01 |
PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] |
-3.446102470000000e+00 |
6.575000000008657e-06 |
7.557471264377768e-01 |
PASS |
| foss-mpi-min: [foss2022a-mpi] |
-3.446102480000000e+00 |
6.565000000069432e-06 |
7.545977011574060e-01 |
PASS |
| foss-serial-full: [foss2023a-serial] |
-3.446102290000000e+00 |
6.755000000246980e-06 |
7.764367816375839e-01 |
PASS |
| foss-serial-min: [foss2023a-serial] |
-3.446102290000000e+00 |
6.755000000246980e-06 |
7.764367816375839e-01 |
PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] |
-3.446101830000000e+00 |
7.215000000115879e-06 |
8.293103448409056e-01 |
PASS |
| foss-mpi-omp-full: [foss2023a-mpi] |
-3.446101470000000e+00 |
7.575000000148435e-06 |
8.706896551894754e-01 |
PASS |
| foss-mpi-min: [foss2023a-mpi] |
-3.446102480000000e+00 |
6.565000000069432e-06 |
7.545977011574060e-01 |
PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] |
-3.446101830000000e+00 |
7.215000000115879e-06 |
8.293103448409056e-01 |
PASS |
| foss-serial-min: [foss2022a-serial] |
-3.446102290000000e+00 |
6.755000000246980e-06 |
7.764367816375839e-01 |
PASS |
| foss_cmake: [foss2022a-serial, foss-full] |
-3.446102320000000e+00 |
6.724999999985215e-06 |
7.729885057454270e-01 |
PASS |
| foss_cmake: [foss2022a-serial, foss-min] |
-3.446102320000000e+00 |
6.724999999985215e-06 |
7.729885057454270e-01 |
PASS |
| foss-mpi-full: [foss2023a-mpi] |
-3.446102480000000e+00 |
6.565000000069432e-06 |
7.545977011574060e-01 |
PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] |
-3.446101830000000e+00 |
7.215000000115879e-06 |
8.293103448409056e-01 |
PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] |
-3.446101830000000e+00 |
7.215000000115879e-06 |
8.293103448409056e-01 |
PASS |
| foss-mpi-opt-full: [foss2023a-mpi] |
-3.446101830000000e+00 |
7.215000000115879e-06 |
8.293103448409056e-01 |
PASS |
| foss-serial-min: [foss2023b-serial] |
-3.446102290000000e+00 |
6.755000000246980e-06 |
7.764367816375839e-01 |
PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] |
-3.446102470000000e+00 |
6.575000000008657e-06 |
7.557471264377768e-01 |
PASS |