Match comparison for molecule-solvent int. energy (match type 24954)

Commits > Commit e20977157e4d251b72bb22e6c23e92a645445263 > Input 29-pcm_chlorine_anion.03-ground_state-n60-poisson.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.215686240000000e+00 1.610000000000000e-07 -3.215686240000000e+00 4.440892098500626e-16 -3.215686240000000e+00 0.000000000000000e+00 PASS
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Detailed information

Reference: -3.21568624, precision: 0.000000161
Run Value Difference Relative difference Status
cmake_foss_2022a_full_serial -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-2022a_ppc -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_min -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-2022a_opt -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-2022b -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_min_mpi -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-2022a -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_full_mpi -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_omp -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_debug -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-2022a_omp -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-2022a_omp -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-2022b_impi -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-2022a_impi -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_min_serial -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_fosscuda-2022a_mpi_omp -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_fosscuda-2022a -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
foss-2022a_mpi_omp -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_foss-2022a -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_foss-2022b_libxc6 -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_foss-2022a_debug -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
intel-2022a_omp_impi -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_foss-2022a_mpi -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_foss-2022b_libxc6_mpi -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS
eb_foss-2022a_mpi_debug -3.215686240000000e+00 0.000000000000000e+00 0.000000000000000e+00 PASS