Match comparison for Hartree energy (match type 11763)

Commits > Commit 94d58911903c32860449c62a795f2d74d19217f9 > Input 17-scfinlcao_alt.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
2.714909395650000e+03 1.360000000000000e-07 2.714909395650000e+03 0.000000000000000e+00 2.714909395650000e+03 0.000000000000000e+00 PASS
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Detailed information

Reference: 2714.9093956499996, precision: 0.000000136
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_cmake: [foss2022a-serial, foss-min] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_min_autotools: [foss2022a-serial] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_min_autotools: [foss2023b-serial] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_min_autotools: [foss2023a-serial] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_cmake: [foss2022a-serial, foss-full] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_autotools: [foss2022a-serial] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_opt_autotools: [foss2023a-serial] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_autotools: [foss2023a-serial] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_autotools: [foss2023b-serial] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
intel_autotools: [intel2023a-serial] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_mpi_min_autotools: [foss2022a-mpi] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_omp_autotools: [foss2023a-serial] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_mpi_min_autotools: [foss2023a-mpi] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_debug_autotools: [foss2023a-serial] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
intel_omp_autotools: [intel2023a-serial] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
intel_omp_autotools: [intel2022a-serial] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_mpi_opt_autotools: [foss2023a-mpi] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_mpi_autotools: [foss2022a-mpi] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_mpi_autotools: [foss2023a-mpi] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_ppc_autotools: [foss2022a-serial] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_cuda_autotools: [foss2022a-cuda-mpi] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
intel_mpi_autotools: [intel2023a-mpi] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_mpi_omp_autotools: [foss2023a-mpi] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS