Match comparison for Energy [step 0] (match type 29345)
Commits >
Commit eddb1a976bbe1f1b2f6bb64793dd776e6572a2b5 >
Input 24-adsic_freeze_orbitals.02-td.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -2.013509098871892e+00 | 1.150000000000000e-13 | -2.013509098871798e+00 | 1.785350429078618e-14 | -2.013509098871838e+00 | 5.329070518200751e-14 | PASS |
Checks for this match
- Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Detailed information
Reference: -2.013509098871892, precision: 0.000000000000115| Run | Value | Difference | Relative difference | Status |
| foss-cmake-zen4: [foss2023a-serial, foss-min] | -2.013509098871797e+00 | 9.547918011776346e-14 | 8.302537401544650e-01 | PASS |
| foss-cmake-zen4: [foss2023a-serial, foss-full] | -2.013509098871797e+00 | 9.547918011776346e-14 | 8.302537401544650e-01 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] | -2.013509098871791e+00 | 1.008082506359642e-13 | 8.765934837909932e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-min] | -2.013509098871800e+00 | 9.192646643896296e-14 | 7.993605777301128e-01 | PASS |
| foss-serial-min: [foss2023b-serial] | -2.013509098871801e+00 | 9.059419880941277e-14 | 7.877756418209807e-01 | PASS |
| foss-serial-min: [foss2022a-serial] | -2.013509098871801e+00 | 9.059419880941277e-14 | 7.877756418209807e-01 | PASS |
| foss-serial-min: [foss2023a-serial] | -2.013509098871801e+00 | 9.059419880941277e-14 | 7.877756418209807e-01 | PASS |
| foss_cmake: [foss2022a-serial, foss-full] | -2.013509098871800e+00 | 9.192646643896296e-14 | 7.993605777301128e-01 | PASS |
| foss-serial-full: [foss2023a-serial] | -2.013509098871801e+00 | 9.059419880941277e-14 | 7.877756418209807e-01 | PASS |
| foss-opt-full: [foss2023a-serial] | -2.013509098871800e+00 | 9.192646643896296e-14 | 7.993605777301128e-01 | PASS |
| intel-serial: [intel2023a-serial] | -2.013509098871799e+00 | 9.325873406851315e-14 | 8.109455136392448e-01 | PASS |
| foss-serial-full: [foss2023b-serial] | -2.013509098871801e+00 | 9.059419880941277e-14 | 7.877756418209807e-01 | PASS |
| foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] | -2.013509098871792e+00 | 1.003641614261142e-13 | 8.727318384879492e-01 | PASS |
| foss-ppc: [foss2022a-serial] | -2.013509098871891e+00 | 8.881784197001252e-16 | 7.723290606088046e-03 | PASS |
| foss-serial-debug: [foss2023a-serial] | -2.013509098871801e+00 | 9.059419880941277e-14 | 7.877756418209807e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-full-mpi] | -2.013509098871790e+00 | 1.021405182655144e-13 | 8.881784197001253e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-full-mpi] | -2.013509098871790e+00 | 1.021405182655144e-13 | 8.881784197001253e-01 | PASS |
| intel-omp: [intel2023a-serial] | -2.013509098871791e+00 | 1.012523398458143e-13 | 8.804551290940372e-01 | PASS |
| intel-omp: [intel2022a-serial] | -2.013509098871788e+00 | 1.039168751049147e-13 | 9.036250009123014e-01 | PASS |
| foss-omp-full: [foss2023a-serial] | -2.013509098871790e+00 | 1.016964290556643e-13 | 8.843167743970813e-01 | PASS |
| foss-mpi-opt-full: [foss2023a-mpi] | -2.013509098871790e+00 | 1.021405182655144e-13 | 8.881784197001253e-01 | PASS |
| foss-mpi-full: [foss2023a-mpi] | -2.013509098871790e+00 | 1.021405182655144e-13 | 8.881784197001253e-01 | PASS |
| foss_cmake: [foss2023a-mpi, foss-min-mpi] | -2.013509098871785e+00 | 1.074695887837152e-13 | 9.345181633366536e-01 | PASS |
| foss_cmake: [foss2022a-mpi, foss-min-mpi] | -2.013509098871785e+00 | 1.074695887837152e-13 | 9.345181633366536e-01 | PASS |
| cuda-serial: [foss2022a-cuda-mpi] | -2.013509098871801e+00 | 9.059419880941277e-14 | 7.877756418209807e-01 | PASS |
| intel_mpi_autotools: [intel2023a-mpi] | -2.013509098871795e+00 | 9.681144774731365e-14 | 8.418386760635971e-01 | PASS |
| foss-mpi-debug: [foss2023a-mpi] | -2.013509098871790e+00 | 1.021405182655144e-13 | 8.881784197001253e-01 | PASS |
| foss-mpi-min: [foss2023a-mpi] | -2.013509098871790e+00 | 1.021405182655144e-13 | 8.881784197001253e-01 | PASS |
| foss-mpi-min: [foss2022a-mpi] | -2.013509098871790e+00 | 1.021405182655144e-13 | 8.881784197001253e-01 | PASS |
| foss-mpi-omp-full: [foss2023a-mpi] | -2.013509098871792e+00 | 1.003641614261142e-13 | 8.727318384879492e-01 | PASS |
| intel_mpi_omp_autotools: [intel2022a-mpi] | -2.013509098871792e+00 | 1.003641614261142e-13 | 8.727318384879492e-01 | PASS |
| cuda-mpi-omp: [foss2022a-cuda-mpi] | -2.013509098871793e+00 | 9.947598300641403e-14 | 8.650085478818612e-01 | PASS |
| valgrind: [foss2023a-serial] | -2.013509098871821e+00 | 7.149836278586008e-14 | 6.217248937900878e-01 | PASS |