Match comparison for gga_xc_b97_d Eigenvalue up (match type 12390)

Commits > Commit 7368b0b20aad13e0ecfc3e36ba5b1a9f5c3d54b1 > Input 03-xc.gga_xc_b97_d.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-9.868770000000000e-01 4.400000000000000e-05 -9.869110740740739e-01 2.095131203517792e-05 -9.868770000000000e-01 4.000000000004000e-05 PASS

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Detailed information

Reference: -0.986877, precision: 0.000044
Run Value Difference Relative difference Status
spack_foss-2022a_serial -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
spack_foss-2022a_ppc -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
spack_foss-2022a_mpi_min -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
spack_foss-2022a_mpi -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
cmake_foss_2022a_min_serial -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
cmake_foss_2022a_full_serial -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
cmake_foss_2022a_min_mpi -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
spack_foss-2022a_serial_min -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
cmake_foss_2022a_full_mpi -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
spack_foss-2023a_serial -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
spack_foss-2023a_mpi_min -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
spack_foss-2023a_serial_min -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
spack_foss-2023a_mpi -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
spack_foss-2023a_mpi_opt -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
spack_foss-2023a_serial_debug -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
spack_foss-2023a_serial_opt -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
spack_foss-2023a_serial_omp -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
spack_foss-2023a_mpi_debug -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
spack_foss-2023b_serial -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
spack_foss-2023a_mpi_omp -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
spack_foss-2022a_cuda_serial -9.868370000000000e-01 4.000000000004000e-05 9.090909090918183e-01 PASS
spack_foss-2022a_cuda_mpi_omp -9.868370000000000e-01 4.000000000004000e-05 9.090909090918183e-01 PASS
spack_intel-2023a_serial -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
spack_intel-2022a_serial_omp -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
spack_intel-2023a_serial_omp -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
spack_intel-2023a_impi -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
spack_intel-2022a_impi_omp -9.869170000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS