Match comparison for gga_xc_pbe1w Int[n*v_xc] (match type 12421)

Commits > Commit 3f3300a09a325083399ad405019c399609c6d1c2 > Input 03-xc.gga_xc_pbe1w.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-4.307628100000000e-01 5.130000000000000e-06 -4.173056853125000e-01 7.495031366552657e-02 -2.153837350000000e-01 2.153837350000000e-01 FAIL

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Detailed information

Reference: -0.43076281, precision: 0.00000513
Run Value Difference Relative difference Status
foss-cmake-zen4: [foss2023a-serial, foss-min] -4.307674500000000e-01 -4.640000000000200e-06 -9.044834307992592e-01 PASS
foss-cmake-zen4: [foss2023a-serial, foss-full] -4.307674500000000e-01 -4.640000000000200e-06 -9.044834307992592e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-full-mpi] -4.307674700000000e-01 -4.659999999989672e-06 -9.083820662747899e-01 PASS
foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi] -4.307674700000000e-01 -4.659999999989672e-06 -9.083820662747899e-01 PASS
foss_cmake: [foss2022a-serial, foss-min] -4.307674500000000e-01 -4.640000000000200e-06 -9.044834307992592e-01 PASS
foss-serial-min: [foss2023a-serial] -4.307674500000000e-01 -4.640000000000200e-06 -9.044834307992592e-01 PASS
foss-serial-min: [foss2022a-serial] -4.307674500000000e-01 -4.640000000000200e-06 -9.044834307992592e-01 PASS
foss-opt-full: [foss2023a-serial] -4.307674500000000e-01 -4.640000000000200e-06 -9.044834307992592e-01 PASS
foss-serial-min: [foss2023b-serial] -4.307674500000000e-01 -4.640000000000200e-06 -9.044834307992592e-01 PASS
foss-serial-full: [foss2023b-serial] -4.307674500000000e-01 -4.640000000000200e-06 -9.044834307992592e-01 PASS
foss_cmake: [foss2022a-serial, foss-full] -4.307674500000000e-01 -4.640000000000200e-06 -9.044834307992592e-01 PASS
intel_autotools: [intel2023a-serial] -4.307674500000000e-01 -4.640000000000200e-06 -9.044834307992592e-01 PASS
foss-serial-full: [foss2023a-serial] -4.307674500000000e-01 -4.640000000000200e-06 -9.044834307992592e-01 PASS
foss-ppc: [foss2022a-serial] -4.307674500000000e-01 -4.640000000000200e-06 -9.044834307992592e-01 PASS
foss_cmake: [foss2022a-mpi, foss-full-mpi] -4.307674700000000e-01 -4.659999999989672e-06 -9.083820662747899e-01 PASS
foss-serial-debug: [foss2023a-serial] -4.307674500000000e-01 -4.640000000000200e-06 -9.044834307992592e-01 PASS
foss_cmake: [foss2023a-mpi, foss-full-mpi] -4.307674700000000e-01 -4.659999999989672e-06 -9.083820662747899e-01 PASS
intel_omp_autotools: [intel2022a-serial] -4.307674500000000e-01 -4.640000000000200e-06 -9.044834307992592e-01 PASS
intel_omp_autotools: [intel2023a-serial] -4.307674500000000e-01 -4.640000000000200e-06 -9.044834307992592e-01 PASS
foss-mpi-opt-full: [foss2023a-mpi] -4.307674700000000e-01 -4.659999999989672e-06 -9.083820662747899e-01 PASS
foss-omp-full: [foss2023a-serial] -4.307674500000000e-01 -4.640000000000200e-06 -9.044834307992592e-01 PASS
foss-mpi-full: [foss2023a-mpi] -4.307674700000000e-01 -4.659999999989672e-06 -9.083820662747899e-01 PASS
foss_cmake: [foss2022a-mpi, foss-min-mpi] -4.307674700000000e-01 -4.659999999989672e-06 -9.083820662747899e-01 PASS
foss_cmake: [foss2023a-mpi, foss-min-mpi] -4.307674700000000e-01 -4.659999999989672e-06 -9.083820662747899e-01 PASS
foss-mpi-min: [foss2022a-mpi] -4.307674700000000e-01 -4.659999999989672e-06 -9.083820662747899e-01 PASS
foss-mpi-min: [foss2023a-mpi] -4.307674700000000e-01 -4.659999999989672e-06 -9.083820662747899e-01 PASS
intel_mpi_autotools: [intel2023a-mpi] -4.307674700000000e-01 -4.659999999989672e-06 -9.083820662747899e-01 PASS
foss_mpi_debug_autotools: [foss2023a-mpi] -4.307674700000000e-01 -4.659999999989672e-06 -9.083820662747899e-01 PASS
foss-mpi-omp-full: [foss2023a-mpi] -4.307674700000000e-01 -4.659999999989672e-06 -9.083820662747899e-01 PASS
cuda-serial: [foss2022a-cuda-mpi] 0.000000000000000e+00 4.307628100000000e-01 8.396935867446393e+04 FAIL
foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] -4.307581500000000e-01 4.659999999989672e-06 9.083820662747899e-01 PASS
intel_mpi_omp_autotools: [intel2022a-mpi] -4.307674700000000e-01 -4.659999999989672e-06 -9.083820662747899e-01 PASS