Match comparison for H2 Multipole x (match type 15308)

Commits > Commit 8520a932a983b5c1584256e5aef0dad9a7dbc2f2 > Input 30-local_multipoles.02-multipoles.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-3.942030529108270e-01 1.970000000000000e-14 -3.942030529108311e-01 1.105380939454904e-15 -3.942030529108325e-01 2.581268532253489e-15 PASS

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Detailed information

Reference: -0.394203052910827, precision: 0.0000000000000197
Run Value Difference Relative difference Status
foss-2022a_ppc -3.942030529108302e-01 -3.164135620181696e-15 -1.606160213290201e-01 PASS
cmake_foss_2022a_full_serial -3.942030529108299e-01 -2.831068712794149e-15 -1.437090717154390e-01 PASS
spack_foss-2022a_serial -3.942030529108320e-01 -4.940492459581947e-15 -2.507864192681191e-01 PASS
foss-2022a_opt -3.942030529108299e-01 -2.831068712794149e-15 -1.437090717154390e-01 PASS
intel-2022b -3.942030529108299e-01 -2.831068712794149e-15 -1.437090717154390e-01 PASS
intel-2022a -3.942030529108299e-01 -2.831068712794149e-15 -1.437090717154390e-01 PASS
cmake_foss_2022a_min_mpi -3.942030529108317e-01 -4.662936703425657e-15 -2.366972945901349e-01 PASS
spack_foss-2022a_serial_debug -3.942030529108320e-01 -4.940492459581947e-15 -2.507864192681191e-01 PASS
cmake_foss_2022a_full_mpi -3.942030529108316e-01 -4.551914400963142e-15 -2.310616447189412e-01 PASS
foss-2022a_omp -3.942030529108301e-01 -3.053113317719180e-15 -1.549803714578264e-01 PASS
eb_fosscuda-2022a -3.942030529108307e-01 -3.719247132494274e-15 -1.887942706849886e-01 PASS
cmake_foss_2022a_min_serial -3.942030529108299e-01 -2.831068712794149e-15 -1.437090717154390e-01 PASS
intel-2022a_omp -3.942030529108318e-01 -4.773959005888173e-15 -2.423329444613286e-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
foss-2022a_mpi_omp -3.942030529108323e-01 -5.273559366969494e-15 -2.676933688817002e-01 PASS
eb_foss-2022a -3.942030529108304e-01 -3.386180225106727e-15 -1.718873210714075e-01 PASS
spack_foss-2022a_serial_min -3.942030529108320e-01 -4.940492459581947e-15 -2.507864192681191e-01 PASS
eb_foss-2022b_libxc6 -3.942030529108307e-01 -3.719247132494274e-15 -1.887942706849886e-01 PASS
eb_fosscuda-2022a_mpi_omp -3.942030529108306e-01 -3.552713678800501e-15 -1.803407958781980e-01 PASS
eb_foss-2022a_debug -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
intel-2022a_omp_impi -3.942030529108306e-01 -3.608224830031759e-15 -1.831586208137949e-01 PASS
eb_foss-2022a_mpi -3.942030529108317e-01 -4.662936703425657e-15 -2.366972945901349e-01 PASS
eb_foss-2022b_libxc6_mpi -3.942030529108316e-01 -4.551914400963142e-15 -2.310616447189412e-01 PASS
eb_foss-2022a_mpi_debug -3.942030529108317e-01 -4.662936703425657e-15 -2.366972945901349e-01 PASS
eb_foss-2022a_valgrind -3.942030529108350e-01 -7.993605777301127e-15 -4.057667907259455e-01 PASS