Match comparison for Total Energy (match type 29216)

Commits > Commit d89ed1adec8f63937926022ba961c15ddb98b66b > Input 20-qedft-breit-2d.01-etac-px.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
2.998474443000000e+00 1.000000000000000e-04 2.998474440000000e+00 0.000000000000000e+00 2.998474440000000e+00 0.000000000000000e+00 PASS
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Detailed information

Reference: 2.998474443, precision: 0.0001
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-full] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss-cmake-zen4: [foss2023a-serial, foss-min] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss-ppc: [foss2022a-serial] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
intel_omp_autotools: [intel2022a-serial] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss-serial-min: [foss2022a-serial] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss-serial-min: [foss2023a-serial] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
intel_omp_autotools: [intel2023a-serial] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss-serial-full: [foss2023a-serial] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss-serial-full: [foss2023b-serial] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss-serial-min: [foss2023b-serial] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss-serial-debug: [foss2023a-serial] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss-opt-full: [foss2023a-serial] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
intel_mpi_autotools: [intel2023a-mpi] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss_cmake: [foss2022a-serial, foss-min] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss-omp-full: [foss2023a-serial] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
intel-serial: [intel2023a-serial] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss_cmake: [foss2022a-serial, foss-full] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss-mpi-full: [foss2023a-mpi] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss-mpi-opt-full: [foss2023a-mpi] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss-mpi-min: [foss2022a-mpi] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss-mpi-min: [foss2023a-mpi] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss-mpi-debug: [foss2023a-mpi] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss-mpi-omp-full: [foss2023a-mpi] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS
cuda-serial: [foss2022a-cuda-mpi] 2.998474440000000e+00 -3.000000248221113e-09 -3.000000248221113e-05 PASS