Match comparison for Ly [step 100] (match type 29478)
Commits >
Commit 9972eae3cc35bad71f44bb929051f5e204f853a2 >
Input 24-adsic_freeze_orbitals.02-td.inp
General information
Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
8.373663656771763e-17 | 1.000000000000000e-04 | -5.868461208166142e-17 | 3.007924263501377e-16 | 2.544519354845016e-17 | 4.750225292708587e-16 | PASS |
Checks for this match
- Precision seems large and value close to zero. Should value be 0?
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Detailed information
Reference: 0.00000000000000008373663656771763, precision: 0.0001Run | Value | Difference | Relative difference | Status |
foss-cmake-zen4: [foss2023a-serial, foss-min] | -1.167873481480231e-16 | -2.005239847157407e-16 | -2.005239847157407e-12 | PASS |
foss-cmake-zen4: [foss2023a-serial, foss-full] | -1.167873481480231e-16 | -2.005239847157407e-16 | -2.005239847157407e-12 | PASS |
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] | 7.302101631689872e-17 | -1.071562025081891e-17 | -1.071562025081891e-13 | PASS |
foss-ppc: [foss2022a-serial] | 3.159429607304217e-16 | 2.322063241627041e-16 | 2.322063241627041e-12 | PASS |
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] | 5.004677228193088e-16 | 4.167310862515912e-16 | 4.167310862515912e-12 | PASS |
foss-serial-min: [foss2022a-serial] | -4.240516992364470e-16 | -5.077883358041646e-16 | -5.077883358041646e-12 | PASS |
foss-serial-min: [foss2023a-serial] | -4.240516992364470e-16 | -5.077883358041646e-16 | -5.077883358041646e-12 | PASS |
foss-serial-full: [foss2023a-serial] | -4.240516992364470e-16 | -5.077883358041646e-16 | -5.077883358041646e-12 | PASS |
foss-serial-full: [foss2023b-serial] | -4.240516992364470e-16 | -5.077883358041646e-16 | -5.077883358041646e-12 | PASS |
intel_omp_autotools: [intel2022a-serial] | -4.495773357224085e-16 | -5.333139722901262e-16 | -5.333139722901262e-12 | PASS |
foss-serial-min: [foss2023b-serial] | -4.240516992364470e-16 | -5.077883358041646e-16 | -5.077883358041646e-12 | PASS |
intel_omp_autotools: [intel2023a-serial] | 2.685188865236228e-16 | 1.847822499559052e-16 | 1.847822499559052e-12 | PASS |
foss-opt-full: [foss2023a-serial] | 1.615512619746664e-16 | 7.781462540694881e-17 | 7.781462540694880e-13 | PASS |
foss-serial-debug: [foss2023a-serial] | -4.240516992364470e-16 | -5.077883358041646e-16 | -5.077883358041646e-12 | PASS |
foss_cmake: [foss2022a-serial, foss-min] | 1.615512619746664e-16 | 7.781462540694881e-17 | 7.781462540694880e-13 | PASS |
intel-serial: [intel2023a-serial] | -2.316492355060057e-16 | -3.153858720737233e-16 | -3.153858720737233e-12 | PASS |
foss_cmake: [foss2022a-serial, foss-full] | 1.615512619746664e-16 | 7.781462540694881e-17 | 7.781462540694880e-13 | PASS |
foss-omp-full: [foss2023a-serial] | 1.887304173851749e-16 | 1.049937808174573e-16 | 1.049937808174573e-12 | PASS |
intel_mpi_autotools: [intel2023a-mpi] | -1.731199818916229e-16 | -2.568566184593406e-16 | -2.568566184593406e-12 | PASS |
foss-mpi-full: [foss2023a-mpi] | 4.057355579983879e-16 | 3.219989214306703e-16 | 3.219989214306702e-12 | PASS |
foss-mpi-opt-full: [foss2023a-mpi] | 2.495020249432267e-16 | 1.657653883755091e-16 | 1.657653883755091e-12 | PASS |
foss_cmake: [foss2022a-mpi, foss-full-mpi] | 2.495020249432267e-16 | 1.657653883755091e-16 | 1.657653883755091e-12 | PASS |
foss-mpi-debug: [foss2023a-mpi] | 4.057355579983879e-16 | 3.219989214306703e-16 | 3.219989214306702e-12 | PASS |
foss_cmake: [foss2023a-mpi, foss-full-mpi] | 2.495020249432267e-16 | 1.657653883755091e-16 | 1.657653883755091e-12 | PASS |
foss-mpi-min: [foss2022a-mpi] | -4.397524011601206e-16 | -5.234890377278382e-16 | -5.234890377278382e-12 | PASS |
foss-mpi-min: [foss2023a-mpi] | -4.397524011601206e-16 | -5.234890377278382e-16 | -5.234890377278382e-12 | PASS |
foss_cmake: [foss2022a-mpi, foss-min-mpi] | -2.385244779468110e-16 | -3.222611145145286e-16 | -3.222611145145286e-12 | PASS |
foss_cmake: [foss2023a-mpi, foss-min-mpi] | -2.385244779468110e-16 | -3.222611145145286e-16 | -3.222611145145286e-12 | PASS |
foss-mpi-omp-full: [foss2023a-mpi] | -3.062871137271550e-18 | -8.679950770498918e-17 | -8.679950770498918e-13 | PASS |
intel_mpi_omp_autotools: [intel2022a-mpi] | 2.055918369575638e-16 | 1.218552003898461e-16 | 1.218552003898461e-12 | PASS |
valgrind: [foss2023a-serial] | -2.465823207504432e-16 | -3.303189573181608e-16 | -3.303189573181608e-12 | PASS |
cuda-serial: [foss2022a-cuda-mpi] | -1.114017732228856e-16 | -1.951384097906032e-16 | -1.951384097906032e-12 | PASS |
cuda-mpi-omp: [foss2022a-cuda-mpi] | -1.836638480190445e-16 | -2.674004845867621e-16 | -2.674004845867621e-12 | PASS |