Match comparison for Partial charge 25 (match type 26809)

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

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
4.045000000000000e+00 2.020000000000000e-02 4.045000000000000e+00 0.000000000000000e+00 4.045000000000000e+00 0.000000000000000e+00 PASS
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Detailed information

Reference: 4.045, precision: 0.0202
Run Value Difference Relative difference Status
spack_foss-2022a_ppc 4.045000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_cuda_serial 4.045000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial 4.045000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_mpi 4.045000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_min 4.045000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_mpi_min 4.045000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_mpi_opt 4.045000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_opt 4.045000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_debug 4.045000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial 4.045000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_cuda_mpi_omp 4.045000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial_omp 4.045000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_mpi_debug 4.045000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial_min 4.045000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2022a_serial_omp 4.045000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2023a_serial 4.045000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2023a_serial_omp 4.045000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2023a_impi 4.045000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2022a_impi_omp 4.045000000000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS