Match comparison for gga_x_pbek1_vdw Int[n*v_xc] (match type 12369)

Commits > Commit 8f782d5cf55620fdc67b764848371cb8de44e683 > Input 03-xc.gga_x_pbek1_vdw.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-4.061309150000000e-01 4.900000000000000e-06 -4.061347029629630e-01 2.334335998562038e-06 -4.061309100000000e-01 4.470000000006413e-06 PASS

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Detailed information

Reference: -0.406130915, precision: 0.0000049
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min -4.061353500000000e-01 -4.435000000024836e-06 -9.051020408213951e-01 PASS
spack_foss-2022a_serial -4.061353500000000e-01 -4.435000000024836e-06 -9.051020408213951e-01 PASS
cmake_foss_2022a_full_serial -4.061353500000000e-01 -4.435000000024836e-06 -9.051020408213951e-01 PASS
cmake_foss_2022a_min_serial -4.061353500000000e-01 -4.435000000024836e-06 -9.051020408213951e-01 PASS
spack_foss-2022a_ppc -4.061353500000000e-01 -4.435000000024836e-06 -9.051020408213951e-01 PASS
spack_foss-2023a_mpi_min -4.061353800000000e-01 -4.465000000009045e-06 -9.112244897977644e-01 PASS
cmake_foss_2022a_min_mpi -4.061353800000000e-01 -4.465000000009045e-06 -9.112244897977644e-01 PASS
cmake_foss_2022a_full_mpi -4.061353800000000e-01 -4.465000000009045e-06 -9.112244897977644e-01 PASS
spack_foss-2022a_cuda_serial -4.061264400000000e-01 4.475000000003782e-06 9.132653061232208e-01 PASS
spack_foss-2023a_mpi -4.061353800000000e-01 -4.465000000009045e-06 -9.112244897977644e-01 PASS
spack_foss-2022a_mpi_min -4.061353800000000e-01 -4.465000000009045e-06 -9.112244897977644e-01 PASS
spack_foss-2022a_cuda_mpi_omp -4.061264600000000e-01 4.454999999958797e-06 9.091836734609792e-01 PASS
spack_foss-2022a_mpi -4.061353800000000e-01 -4.465000000009045e-06 -9.112244897977644e-01 PASS
spack_foss-2023a_mpi_debug -4.061353800000000e-01 -4.465000000009045e-06 -9.112244897977644e-01 PASS
spack_foss-2023a_serial -4.061353500000000e-01 -4.435000000024836e-06 -9.051020408213951e-01 PASS
spack_foss-2023a_mpi_opt -4.061353800000000e-01 -4.465000000009045e-06 -9.112244897977644e-01 PASS
spack_foss-2023a_serial_min -4.061353500000000e-01 -4.435000000024836e-06 -9.051020408213951e-01 PASS
spack_foss-2023a_serial_debug -4.061353500000000e-01 -4.435000000024836e-06 -9.051020408213951e-01 PASS
spack_foss-2023a_mpi_omp -4.061353800000000e-01 -4.465000000009045e-06 -9.112244897977644e-01 PASS
spack_foss-2023a_serial_opt -4.061353500000000e-01 -4.435000000024836e-06 -9.051020408213951e-01 PASS
spack_foss-2023b_serial -4.061353500000000e-01 -4.435000000024836e-06 -9.051020408213951e-01 PASS
spack_foss-2023a_serial_omp -4.061353500000000e-01 -4.435000000024836e-06 -9.051020408213951e-01 PASS
spack_intel-2023a_serial -4.061353500000000e-01 -4.435000000024836e-06 -9.051020408213951e-01 PASS
spack_intel-2022a_serial_omp -4.061353500000000e-01 -4.435000000024836e-06 -9.051020408213951e-01 PASS
spack_intel-2023a_serial_omp -4.061353500000000e-01 -4.435000000024836e-06 -9.051020408213951e-01 PASS
spack_intel-2023a_impi -4.061353800000000e-01 -4.465000000009045e-06 -9.112244897977644e-01 PASS
spack_intel-2022a_impi_omp -4.061353800000000e-01 -4.465000000009045e-06 -9.112244897977644e-01 PASS