Match comparison for Tamm-Dancoff spectrum tot (match type 13650)

Commits > Commit dd0acda4415b0ab64c529ca4a26922f9782edb94 > Input 01-casida.09-spectrum.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
8.294709000000001e+00 1.540000000000000e-05 8.294714740740741e+00 8.876071004829589e-06 8.294709000000001e+00 1.399999999929236e-05 PASS
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Detailed information

Reference: 8.294709000000001, precision: 0.0000154
Run Value Difference Relative difference Status
cmake_foss_2022a_full_serial 8.294722999999999e+00 1.399999999840418e-05 9.090909089872842e-01 PASS
spack_foss-2022a_ppc 8.294720999999999e+00 1.199999999812462e-05 7.792207790990013e-01 PASS
cmake_foss_2022a_min_serial 8.294722999999999e+00 1.399999999840418e-05 9.090909089872842e-01 PASS
cmake_foss_2022a_min_mpi 8.294708999999999e+00 -1.776356839400250e-15 -1.153478467143020e-10 PASS
cmake_foss_2022a_full_mpi 8.294713000000000e+00 3.999999998782755e-06 2.597402596612178e-01 PASS
spack_foss-2022a_mpi_min 8.294713000000000e+00 3.999999998782755e-06 2.597402596612178e-01 PASS
spack_foss-2022a_mpi 8.294713000000000e+00 3.999999998782755e-06 2.597402596612178e-01 PASS
spack_foss-2022a_serial 8.294722999999999e+00 1.399999999840418e-05 9.090909089872842e-01 PASS
spack_foss-2022a_serial_min 8.294722999999999e+00 1.399999999840418e-05 9.090909089872842e-01 PASS
spack_foss-2023a_mpi 8.294713000000000e+00 3.999999998782755e-06 2.597402596612178e-01 PASS
spack_foss-2023a_mpi_min 8.294713000000000e+00 3.999999998782755e-06 2.597402596612178e-01 PASS
spack_foss-2023a_serial_min 8.294722999999999e+00 1.399999999840418e-05 9.090909089872842e-01 PASS
spack_foss-2023a_serial 8.294722999999999e+00 1.399999999840418e-05 9.090909089872842e-01 PASS
spack_foss-2023a_mpi_opt 8.294713000000000e+00 3.999999998782755e-06 2.597402596612178e-01 PASS
spack_foss-2023a_mpi_debug 8.294713000000000e+00 3.999999998782755e-06 2.597402596612178e-01 PASS
spack_foss-2023a_serial_opt 8.294722999999999e+00 1.399999999840418e-05 9.090909089872842e-01 PASS
spack_foss-2023b_serial 8.294722999999999e+00 1.399999999840418e-05 9.090909089872842e-01 PASS
spack_foss-2023a_serial_debug 8.294722999999999e+00 1.399999999840418e-05 9.090909089872842e-01 PASS
spack_foss-2023a_serial_omp 8.294708999999999e+00 -1.776356839400250e-15 -1.153478467143020e-10 PASS
spack_intel-2022a_serial_omp 8.294717000000000e+00 7.999999999341867e-06 5.194805194377835e-01 PASS
spack_foss-2023a_mpi_omp 8.294722999999999e+00 1.399999999840418e-05 9.090909089872842e-01 PASS
spack_intel-2023a_serial 8.294698000000000e+00 -1.100000000064938e-05 -7.142857143278817e-01 PASS
spack_intel-2023a_impi 8.294722000000000e+00 1.299999999915258e-05 8.441558441008167e-01 PASS
spack_foss-2022a_cuda_mpi_omp 8.294696000000000e+00 -1.300000000092894e-05 -8.441558442161645e-01 PASS
spack_intel-2023a_serial_omp 8.294695000000001e+00 -1.400000000018053e-05 -9.090909091026320e-01 PASS
spack_intel-2022a_impi_omp 8.294710000000000e+00 9.999999992515995e-07 6.493506488646750e-02 PASS
spack_foss-2022a_cuda_serial 8.294700000000001e+00 -9.000000000369823e-06 -5.844155844395988e-01 PASS