Match comparison for H2 Multipole y (match type 15309)
Commits >
Commit daa93de2f371acc02c8ba320d7b5759725cfd1f4 >
Input 30-local_multipoles.02-multipoles.inp
General information
| Reference | Precision | Mean | Standard deviation | Midpoint | Half width | Status |
| -3.942030529108270e-01 | 1.970000000000000e-14 | -3.942030529108313e-01 | 1.077116613231302e-15 | -3.942030529108319e-01 | 2.581268532253489e-15 | PASS |
Checks for this match
- Mid point of values far away from reference. Recentering may be necessary.
Loading plot...
Detailed information
Reference: -0.394203052910827, precision: 0.0000000000000197| Run | Value | Difference | Relative difference | Status |
| cmake_foss_2022a_full_serial | -3.942030529108305e-01 | -3.497202527569243e-15 | -1.775229709426012e-01 | PASS |
| spack_foss-2022a_serial_min | -3.942030529108324e-01 | -5.384581669432009e-15 | -2.733290187528938e-01 | PASS |
| foss-2022a_ppc | -3.942030529108294e-01 | -2.331468351712829e-15 | -1.183486472950674e-01 | PASS |
| spack_foss-2022a_serial_opt | -3.942030529108305e-01 | -3.497202527569243e-15 | -1.775229709426012e-01 | PASS |
| spack_foss-2022a_serial | -3.942030529108324e-01 | -5.384581669432009e-15 | -2.733290187528938e-01 | PASS |
| foss-2022a_opt | -3.942030529108302e-01 | -3.164135620181696e-15 | -1.606160213290201e-01 | PASS |
| intel-2022b | -3.942030529108304e-01 | -3.386180225106727e-15 | -1.718873210714075e-01 | PASS |
| intel-2022a | -3.942030529108304e-01 | -3.386180225106727e-15 | -1.718873210714075e-01 | PASS |
| spack_foss-2022a_serial_omp | -3.942030529108303e-01 | -3.275157922644212e-15 | -1.662516712002138e-01 | PASS |
| cmake_foss_2022a_full_mpi | -3.942030529108318e-01 | -4.773959005888173e-15 | -2.423329444613286e-01 | PASS |
| spack_foss-2022a_serial_debug | -3.942030529108324e-01 | -5.384581669432009e-15 | -2.733290187528938e-01 | PASS |
| foss-2022a_omp | -3.942030529108304e-01 | -3.386180225106727e-15 | -1.718873210714075e-01 | PASS |
| intel-2022a_omp | -3.942030529108324e-01 | -5.384581669432009e-15 | -2.733290187528938e-01 | PASS |
| intel-2022b_impi | -3.942030529108309e-01 | -3.885780586188048e-15 | -1.972477454917791e-01 | PASS |
| intel-2022a_impi | -3.942030529108309e-01 | -3.885780586188048e-15 | -1.972477454917791e-01 | PASS |
| eb_fosscuda-2022a_mpi_omp | -3.942030529108313e-01 | -4.274358644806853e-15 | -2.169725200409570e-01 | PASS |
| eb_fosscuda-2022a | -3.942030529108310e-01 | -3.996802888650564e-15 | -2.028833953629728e-01 | PASS |
| cmake_foss_2022a_min_serial | -3.942030529108305e-01 | -3.497202527569243e-15 | -1.775229709426012e-01 | PASS |
| foss-2022a_mpi_omp | -3.942030529108323e-01 | -5.273559366969494e-15 | -2.676933688817002e-01 | PASS |
| cmake_foss_2022a_min_mpi | -3.942030529108323e-01 | -5.273559366969494e-15 | -2.676933688817002e-01 | PASS |
| eb_foss-2022a | -3.942030529108300e-01 | -2.942091015256665e-15 | -1.493447215866327e-01 | PASS |
| eb_foss-2022b_libxc6 | -3.942030529108314e-01 | -4.329869796038111e-15 | -2.197903449765538e-01 | PASS |
| eb_foss-2022a_debug | -3.942030529108300e-01 | -2.942091015256665e-15 | -1.493447215866327e-01 | PASS |
| intel-2022a_omp_impi | -3.942030529108316e-01 | -4.551914400963142e-15 | -2.310616447189412e-01 | PASS |
| eb_foss-2022a_mpi | -3.942030529108318e-01 | -4.773959005888173e-15 | -2.423329444613286e-01 | PASS |
| eb_foss-2022b_libxc6_mpi | -3.942030529108318e-01 | -4.773959005888173e-15 | -2.423329444613286e-01 | PASS |
| eb_foss-2022a_mpi_debug | -3.942030529108318e-01 | -4.773959005888173e-15 | -2.423329444613286e-01 | PASS |
| eb_foss-2022a_valgrind | -3.942030529108345e-01 | -7.494005416219807e-15 | -3.804063663055740e-01 | PASS |