Match comparison for Hartree energy (match type 31686)

Commits > Commit 4e4258e65e606bf002e3af34a10a78b31d6cc70d > Input 18-mgga.01-br89.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
4.641743610000000e+00 2.320000000000000e-07 4.641743609696970e+00 1.714198247004086e-09 4.641743605000000e+00 4.999999969612645e-09 PASS
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Detailed information

Reference: 4.64174361, precision: 0.000000232
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-min: [foss2023a-serial] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-min: [foss2023b-serial] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-full: [foss2023a-serial] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-min: [foss2022a-serial] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-ppc: [foss2022a-serial] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-full: [foss2023b-serial] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-opt-full: [foss2023a-serial] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2022a-serial, foss-min] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_omp_autotools: [intel2022a-serial] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_omp_autotools: [intel2023a-serial] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2022a-serial, foss-full] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-serial-debug: [foss2023a-serial] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-serial: [intel2023a-serial] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-omp-full: [foss2023a-serial] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-opt-full: [foss2023a-mpi] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_mpi_autotools: [intel2023a-mpi] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-full: [foss2023a-mpi] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-debug: [foss2023a-mpi] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-min: [foss2022a-mpi] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-min: [foss2023a-mpi] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-mpi-omp-full: [foss2023a-mpi] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
valgrind: [foss2023a-serial] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
cuda-serial: [foss2022a-cuda-mpi] 4.641743600000000e+00 -9.999999939225290e-09 -4.310344801390211e-02 PASS
cuda-mpi-omp: [foss2022a-cuda-mpi] 4.641743610000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS