Match comparison for Partial charge 55 (match type 26815)

Commits > Commit e20977157e4d251b72bb22e6c23e92a645445263 > Input 10-vdw_d3_dna.01-gs_novdw.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
9.960000000000000e-01 4.980000000000000e-02 9.959999999999999e-01 1.110223024625157e-16 9.960000000000000e-01 0.000000000000000e+00 PASS
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Detailed information

Reference: 0.996, precision: 0.0498
Run Value Difference Relative difference Status
cmake_foss_2022a_full_serial 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-2022a_ppc 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_min 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-2022a_opt 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-2022b 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_min_mpi 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-2022a 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_full_mpi 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_omp 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_debug 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-2022a_omp 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-2022a_omp 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-2022b_impi 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-2022a_impi 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_min_serial 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_fosscuda-2022a_mpi_omp 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_fosscuda-2022a 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-2022a_mpi_omp 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_foss-2022a 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_foss-2022b_libxc6 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_foss-2022a_debug 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-2022a_omp_impi 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_foss-2022a_mpi 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_foss-2022b_libxc6_mpi 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_foss-2022a_mpi_debug 9.960000000000000e-01 0.000000000000000e+00 0.000000000000000e+00 PASS