Match comparison for gga_x_pbe Int[n*v_xc] (match type 12349)

Commits > Commit a4341ac9f169107ec4cef5019cc6269df7c401ac > Input 03-xc.gga_x_pbe.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-4.037898600000000e-01 4.860000000000000e-06 -4.037936181481481e-01 2.316003961229838e-06 -4.037898550000000e-01 4.434999999997080e-06 PASS

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Detailed information

Reference: -0.40378986, precision: 0.00000486
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min -4.037942600000000e-01 -4.400000000015503e-06 -9.053497942418730e-01 PASS
spack_foss-2023a_serial_min -4.037942600000000e-01 -4.400000000015503e-06 -9.053497942418730e-01 PASS
spack_foss-2023a_serial -4.037942600000000e-01 -4.400000000015503e-06 -9.053497942418730e-01 PASS
spack_foss-2023a_serial_opt -4.037942600000000e-01 -4.400000000015503e-06 -9.053497942418730e-01 PASS
spack_foss-2022a_serial -4.037942600000000e-01 -4.400000000015503e-06 -9.053497942418730e-01 PASS
spack_foss-2023b_serial -4.037942600000000e-01 -4.400000000015503e-06 -9.053497942418730e-01 PASS
spack_foss-2022a_ppc -4.037942600000000e-01 -4.400000000015503e-06 -9.053497942418730e-01 PASS
spack_foss-2022a_mpi_min -4.037942900000000e-01 -4.429999999999712e-06 -9.115226337447967e-01 PASS
spack_foss-2023a_mpi_min -4.037942900000000e-01 -4.429999999999712e-06 -9.115226337447967e-01 PASS
spack_foss-2023a_serial_debug -4.037942600000000e-01 -4.400000000015503e-06 -9.053497942418730e-01 PASS
spack_foss-2023a_serial_omp -4.037942600000000e-01 -4.400000000015503e-06 -9.053497942418730e-01 PASS
spack_foss-2022a_cuda_serial -4.037854200000000e-01 4.439999999994448e-06 9.135802469124379e-01 PASS
spack_foss-2023a_mpi_opt -4.037942900000000e-01 -4.429999999999712e-06 -9.115226337447967e-01 PASS
spack_foss-2022a_mpi -4.037942900000000e-01 -4.429999999999712e-06 -9.115226337447967e-01 PASS
spack_foss-2023a_mpi -4.037942900000000e-01 -4.429999999999712e-06 -9.115226337447967e-01 PASS
cmake_foss_2022a_full_mpi -4.037942900000000e-01 -4.429999999999712e-06 -9.115226337447967e-01 PASS
spack_foss-2022a_cuda_mpi_omp -4.037854400000000e-01 4.420000000004976e-06 9.094650205771554e-01 PASS
spack_foss-2023a_mpi_debug -4.037942900000000e-01 -4.429999999999712e-06 -9.115226337447967e-01 PASS
spack_foss-2023a_mpi_omp -4.037942900000000e-01 -4.429999999999712e-06 -9.115226337447967e-01 PASS
cmake_foss_2022a_min_serial -4.037942600000000e-01 -4.400000000015503e-06 -9.053497942418730e-01 PASS
cmake_foss_2022a_full_serial -4.037942600000000e-01 -4.400000000015503e-06 -9.053497942418730e-01 PASS
cmake_foss_2022a_min_mpi -4.037942900000000e-01 -4.429999999999712e-06 -9.115226337447967e-01 PASS
spack_intel-2023a_serial -4.037942600000000e-01 -4.400000000015503e-06 -9.053497942418730e-01 PASS
spack_intel-2022a_serial_omp -4.037942600000000e-01 -4.400000000015503e-06 -9.053497942418730e-01 PASS
spack_intel-2023a_serial_omp -4.037942600000000e-01 -4.400000000015503e-06 -9.053497942418730e-01 PASS
spack_intel-2023a_impi -4.037942900000000e-01 -4.429999999999712e-06 -9.115226337447967e-01 PASS
spack_intel-2022a_impi_omp -4.037942900000000e-01 -4.429999999999712e-06 -9.115226337447967e-01 PASS