Match comparison for Partial charge 40 (match type 26812)

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

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
8.500000000000000e-01 4.250000000000000e-01 9.819999999999999e-01 1.110223024625157e-16 9.820000000000000e-01 0.000000000000000e+00 PASS

Checks for this match

  • Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Get updated match line Get updated match line with fixed reference

Detailed information

Reference: 0.85, precision: 0.425
Run Value Difference Relative difference Status
spack_foss-2022a_ppc 9.820000000000000e-01 1.320000000000000e-01 3.105882352941177e-01 PASS
spack_foss-2022a_cuda_serial 9.820000000000000e-01 1.320000000000000e-01 3.105882352941177e-01 PASS
spack_foss-2022a_serial 9.820000000000000e-01 1.320000000000000e-01 3.105882352941177e-01 PASS
spack_foss-2022a_mpi 9.820000000000000e-01 1.320000000000000e-01 3.105882352941177e-01 PASS
spack_foss-2022a_serial_min 9.820000000000000e-01 1.320000000000000e-01 3.105882352941177e-01 PASS
spack_foss-2022a_mpi_min 9.820000000000000e-01 1.320000000000000e-01 3.105882352941177e-01 PASS
spack_foss-2022a_mpi_opt 9.820000000000000e-01 1.320000000000000e-01 3.105882352941177e-01 PASS
spack_foss-2022a_serial_opt 9.820000000000000e-01 1.320000000000000e-01 3.105882352941177e-01 PASS
spack_foss-2022a_serial_debug 9.820000000000000e-01 1.320000000000000e-01 3.105882352941177e-01 PASS
spack_foss-2023a_serial 9.820000000000000e-01 1.320000000000000e-01 3.105882352941177e-01 PASS
spack_foss-2022a_cuda_mpi_omp 9.820000000000000e-01 1.320000000000000e-01 3.105882352941177e-01 PASS
spack_foss-2023a_serial_omp 9.820000000000000e-01 1.320000000000000e-01 3.105882352941177e-01 PASS
spack_foss-2022a_mpi_debug 9.820000000000000e-01 1.320000000000000e-01 3.105882352941177e-01 PASS
spack_foss-2023a_serial_min 9.820000000000000e-01 1.320000000000000e-01 3.105882352941177e-01 PASS
spack_intel-2022a_serial_omp 9.820000000000000e-01 1.320000000000000e-01 3.105882352941177e-01 PASS
spack_intel-2023a_serial 9.820000000000000e-01 1.320000000000000e-01 3.105882352941177e-01 PASS
spack_intel-2023a_serial_omp 9.820000000000000e-01 1.320000000000000e-01 3.105882352941177e-01 PASS
spack_intel-2023a_impi 9.820000000000000e-01 1.320000000000000e-01 3.105882352941177e-01 PASS
spack_intel-2022a_impi_omp 9.820000000000000e-01 1.320000000000000e-01 3.105882352941177e-01 PASS