Match comparison for gga_x_optb88_vdw Int[n*v_xc] (match type 12337)

Commits > Commit 3f3300a09a325083399ad405019c399609c6d1c2 > Input 03-xc.gga_x_optb88_vdw.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.994679000000000e-01 4.740000000000000e-06 -3.869884240624999e-01 6.950517280073670e-02 -1.997361050000000e-01 1.997361050000000e-01 FAIL

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Detailed information

Reference: -0.3994679, precision: 0.00000474
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -3.994721900000000e-01 -4.290000000017891e-06 -9.050632911430149e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -3.994721900000000e-01 -4.290000000017891e-06 -9.050632911430149e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -3.994722100000000e-01 -4.310000000007363e-06 -9.092827004234943e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -3.994722100000000e-01 -4.310000000007363e-06 -9.092827004234943e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -3.994721900000000e-01 -4.290000000017891e-06 -9.050632911430149e-01 PASS
foss-serial-min: [foss2023a-serial] -3.994721900000000e-01 -4.290000000017891e-06 -9.050632911430149e-01 PASS
foss-serial-min: [foss2022a-serial] -3.994721900000000e-01 -4.290000000017891e-06 -9.050632911430149e-01 PASS
foss-opt-full: [foss2023a-serial] -3.994721900000000e-01 -4.290000000017891e-06 -9.050632911430149e-01 PASS
foss-serial-min: [foss2023b-serial] -3.994721900000000e-01 -4.290000000017891e-06 -9.050632911430149e-01 PASS
foss-serial-full: [foss2023b-serial] -3.994721900000000e-01 -4.290000000017891e-06 -9.050632911430149e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -3.994721900000000e-01 -4.290000000017891e-06 -9.050632911430149e-01 PASS
intel_autotools: [intel2023a-serial] -3.994721900000000e-01 -4.290000000017891e-06 -9.050632911430149e-01 PASS
foss-serial-full: [foss2023a-serial] -3.994721900000000e-01 -4.290000000017891e-06 -9.050632911430149e-01 PASS
foss-ppc: [foss2022a-serial] -3.994721900000000e-01 -4.290000000017891e-06 -9.050632911430149e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -3.994722100000000e-01 -4.310000000007363e-06 -9.092827004234943e-01 PASS
foss-serial-debug: [foss2023a-serial] -3.994721900000000e-01 -4.290000000017891e-06 -9.050632911430149e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -3.994722100000000e-01 -4.310000000007363e-06 -9.092827004234943e-01 PASS
intel_omp_autotools: [intel2022a-serial] -3.994721900000000e-01 -4.290000000017891e-06 -9.050632911430149e-01 PASS
intel_omp_autotools: [intel2023a-serial] -3.994721900000000e-01 -4.290000000017891e-06 -9.050632911430149e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] -3.994722100000000e-01 -4.310000000007363e-06 -9.092827004234943e-01 PASS
foss-omp-full: [foss2023a-serial] -3.994721900000000e-01 -4.290000000017891e-06 -9.050632911430149e-01 PASS
foss-mpi-full: [foss2023a-mpi] -3.994722100000000e-01 -4.310000000007363e-06 -9.092827004234943e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -3.994722100000000e-01 -4.310000000007363e-06 -9.092827004234943e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -3.994722100000000e-01 -4.310000000007363e-06 -9.092827004234943e-01 PASS
foss-mpi-min: [foss2022a-mpi] -3.994722100000000e-01 -4.310000000007363e-06 -9.092827004234943e-01 PASS
foss-mpi-min: [foss2023a-mpi] -3.994722100000000e-01 -4.310000000007363e-06 -9.092827004234943e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -3.994722100000000e-01 -4.310000000007363e-06 -9.092827004234943e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -3.994722100000000e-01 -4.310000000007363e-06 -9.092827004234943e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] -3.994722100000000e-01 -4.310000000007363e-06 -9.092827004234943e-01 PASS
cuda-serial: [foss2022a-cuda-mpi] 0.000000000000000e+00 3.994679000000000e-01 8.427592827004219e+04 FAIL
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -3.994635900000000e-01 4.310000000007363e-06 9.092827004234943e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -3.994722100000000e-01 -4.310000000007363e-06 -9.092827004234943e-01 PASS