Match comparison for MVORB HSE06 Fock Int[n*v_xc] (match type 23350)

Commits > Commit 32ddd3547162625b90bad3fe3e58ca7314bc5873 > Input 03-xc.mvorb_hse06_fock.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-2.586638600000000e-01 3.130000000000000e-06 -2.586615880000001e-01 1.477316486060587e-06 -2.586638550000000e-01 2.845000000001319e-06 PASS

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Detailed information

Reference: -0.25866386, precision: 0.00000313
Run Value Difference Relative difference Status
foss-2022a_ppc -2.586612300000000e-01 2.630000000003463e-06 8.402555910554195e-01 PASS
eb_fosscuda-2022a -2.586664700000000e-01 -2.609999999958479e-06 -8.338658146832201e-01 PASS
cmake_foss_2022a_full_serial -2.586612300000000e-01 2.630000000003463e-06 8.402555910554195e-01 PASS
cmake_foss_2022a_full_mpi -2.586610100000000e-01 2.849999999998687e-06 9.105431309899958e-01 PASS
cmake_foss_2022a_min_serial -2.586612300000000e-01 2.630000000003463e-06 8.402555910554195e-01 PASS
cmake_foss_2022a_min_mpi -2.586610100000000e-01 2.849999999998687e-06 9.105431309899958e-01 PASS
eb_foss-2022a -2.586612300000000e-01 2.630000000003463e-06 8.402555910554195e-01 PASS
eb_foss-2022a_debug -2.586612300000000e-01 2.630000000003463e-06 8.402555910554195e-01 PASS
eb_foss-2022b_libxc6 -2.586612300000000e-01 2.630000000003463e-06 8.402555910554195e-01 PASS
foss-2022a_opt -2.586612300000000e-01 2.630000000003463e-06 8.402555910554195e-01 PASS
eb_foss-2022a_mpi -2.586610100000000e-01 2.849999999998687e-06 9.105431309899958e-01 PASS
foss-2022a_omp -2.586612300000000e-01 2.630000000003463e-06 8.402555910554195e-01 PASS
eb_foss-2022b_libxc6_mpi -2.586610100000000e-01 2.849999999998687e-06 9.105431309899958e-01 PASS
intel-2022a -2.586612300000000e-01 2.630000000003463e-06 8.402555910554195e-01 PASS
foss-2022a_mpi_omp -2.586610100000000e-01 2.849999999998687e-06 9.105431309899958e-01 PASS
eb_foss-2022a_mpi_debug -2.586610100000000e-01 2.849999999998687e-06 9.105431309899958e-01 PASS
intel-2022b -2.586612300000000e-01 2.630000000003463e-06 8.402555910554195e-01 PASS
intel-2022a_omp -2.586612300000000e-01 2.630000000003463e-06 8.402555910554195e-01 PASS
eb_fosscuda-2022a_mpi_omp -2.586667000000000e-01 -2.840000000003950e-06 -9.073482428127637e-01 PASS
spack_foss-2022a_serial -2.586612300000000e-01 2.630000000003463e-06 8.402555910554195e-01 PASS
intel-2022a_impi -2.586610100000000e-01 2.849999999998687e-06 9.105431309899958e-01 PASS
spack_foss-2022a_serial_min -2.586612300000000e-01 2.630000000003463e-06 8.402555910554195e-01 PASS
spack_foss-2022a_serial_omp -2.586612300000000e-01 2.630000000003463e-06 8.402555910554195e-01 PASS
spack_foss-2022a_serial_debug -2.586612300000000e-01 2.630000000003463e-06 8.402555910554195e-01 PASS
intel-2022a_omp_impi -2.586610100000000e-01 2.849999999998687e-06 9.105431309899958e-01 PASS