Match comparison for gga_xc_pbe1w Eigenvalue up (match type 12418)

Commits > Commit 34a88ed67d1e43cec43030663c55a516d3c2803d > Input 03-xc.gga_xc_pbe1w.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-9.897790000000000e-01 4.400000000000000e-05 -9.898120434782610e-01 2.254170677706208e-05 -9.897790000000000e-01 3.999999999998449e-05 PASS

Checks for this match

  • GPU builders have different values.
    • Intel® builders have different values.
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Detailed information

Reference: -0.989779, precision: 0.000044
Run Value Difference Relative difference Status
foss-2022a_ppc -9.898190000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
cmake_foss_2022a_full_serial -9.898190000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
cmake_foss_2022a_min_serial -9.898190000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
cmake_foss_2022a_full_mpi -9.898190000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
cmake_foss_2022a_min_mpi -9.898190000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
eb_foss-2022a -9.898190000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
eb_fosscuda-2022a -9.897390000000000e-01 3.999999999992898e-05 9.090909090892950e-01 PASS
eb_foss-2022a_debug -9.898190000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
eb_foss-2022b_libxc6 -9.898190000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
eb_foss-2022a_mpi -9.898190000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss-2022a_opt -9.898190000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
eb_fosscuda-2022a_mpi_omp -9.897390000000000e-01 3.999999999992898e-05 9.090909090892950e-01 PASS
intel-2022a -9.898190000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
eb_foss-2022b_libxc6_mpi -9.898190000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss-2022a_omp -9.898190000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
intel-2022b -9.898190000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
eb_foss-2022a_mpi_debug -9.898190000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
intel-2022a_omp -9.898190000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
intel-2022a_impi -9.898190000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
spack_foss-2022a_serial -9.898190000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
intel-2022b_impi -9.898190000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
foss-2022a_mpi_omp -9.898190000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS
spack_foss-2022a_serial_min -9.898190000000000e-01 -4.000000000004000e-05 -9.090909090918183e-01 PASS