Match comparison for Total energy (match type 11760)

Commits > Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc > Input 17-scfinlcao_alt.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-1.390517814050000e+03 6.949999999999999e-08 -1.390515917033529e+03 7.353747375568400e-03 -1.390502161710000e+03 1.565233999997417e-02 FAIL

Checks for this match

  • Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Get updated match line Get updated match line with fixed reference

Detailed information

Reference: -1390.51781405, precision: 0.0000000695
Run Value Difference Relative difference Status
intel-serial: [intel2023a-serial] -1.390517814050000e+03 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial: [foss2023a-serial] -1.390517814050000e+03 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-debug: [foss2023a-serial] -1.390517814050000e+03 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-min-parallel: [intel2022a-mpi] -1.390517814050000e+03 0.000000000000000e+00 0.000000000000000e+00 PASS
ppc: [foss2023a-serial] -1.390517814050000e+03 0.000000000000000e+00 0.000000000000000e+00 PASS
autotools_foss_mpi_omp: [foss2023a-mpi] -1.390517814050000e+03 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-parallel-debug: [foss2023a-mpi] -1.390517814050000e+03 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-parallel: [intel2023a-mpi] -1.390517814050000e+03 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-parallel: [foss2023a-mpi] -1.390517814050000e+03 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-min-parallel: [foss2023b-mpi] -1.390517814050000e+03 0.000000000000000e+00 0.000000000000000e+00 PASS
autotools_intel_mpi_omp: [intel2023a-mpi] -1.390517814050000e+03 0.000000000000000e+00 0.000000000000000e+00 PASS
address-sanitizer: [foss2023a-serial, ci-foss-full] -1.390517814050000e+03 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-min-parallel: [foss2022a-mpi] -1.390486509370000e+03 3.130467999994835e-02 4.504270503589691e+05 FAIL
intel-serial-debug: [intel2023a-serial] -1.390517814050000e+03 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-parallel-debug: [intel2023a-mpi] -1.390517814050000e+03 0.000000000000000e+00 0.000000000000000e+00 PASS
cuda: [foss2022a-cuda-mpi, ci-foss-full-cuda] -1.390517525460000e+03 2.885900000819674e-04 4.152374101898812e+03 FAIL
cuda: [foss2022a-cuda-mpi, ci-foss-full-mpi-omp-cuda] -1.390517158040000e+03 6.560100000569946e-04 9.438992806575463e+03 FAIL