Match comparison for Partial charge 35 (match type 26811)

Commits > Commit babc485c55a2119a415aa56305cb49f398154cb7 > Input 10-vdw_d3_dna.01-gs_novdw.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
5.971000000000000e+00 2.990000000000000e-02 5.971000000000001e+00 8.881784197001252e-16 5.971000000000000e+00 0.000000000000000e+00 PASS
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Detailed information

Reference: 5.971, precision: 0.0299
Run Value Difference Relative difference Status
spack_foss-2022a_ppc 5.971000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_cuda_serial 5.971000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial 5.971000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_mpi 5.971000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_min 5.971000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_mpi_min 5.971000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_mpi_opt 5.971000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_opt 5.971000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_debug 5.971000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial 5.971000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_cuda_mpi_omp 5.971000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial_omp 5.971000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_mpi_debug 5.971000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial_min 5.971000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2022a_serial_omp 5.971000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2023a_serial 5.971000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2023a_serial_omp 5.971000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2023a_impi 5.971000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2022a_impi_omp 5.971000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS