Match comparison for Hartree energy (match type 11763)

Commits > Commit 32ddd3547162625b90bad3fe3e58ca7314bc5873 > Input 17-scfinlcao_alt.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
2.714909395650000e+03 1.360000000000000e-07 2.714909395650000e+03 0.000000000000000e+00 2.714909395650000e+03 0.000000000000000e+00 PASS
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Detailed information

Reference: 2714.9093956499996, precision: 0.000000136
Run Value Difference Relative difference Status
foss-2022a_ppc 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
eb_fosscuda-2022a 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
cmake_foss_2022a_full_serial 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
cmake_foss_2022a_full_mpi 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
cmake_foss_2022a_min_serial 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
cmake_foss_2022a_min_mpi 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
eb_foss-2022a 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
eb_foss-2022a_debug 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
eb_foss-2022b_libxc6 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss-2022a_opt 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
eb_foss-2022a_mpi 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss-2022a_omp 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
eb_foss-2022b_libxc6_mpi 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
intel-2022a 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
foss-2022a_mpi_omp 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
eb_foss-2022a_mpi_debug 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
intel-2022b 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
intel-2022a_omp 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
eb_fosscuda-2022a_mpi_omp 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
spack_foss-2022a_serial 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
intel-2022a_impi 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
spack_foss-2022a_serial_min 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
spack_foss-2022a_serial_omp 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
spack_foss-2022a_serial_debug 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS
intel-2022a_omp_impi 2.714909395650000e+03 4.547473508864641e-13 3.343730521224001e-06 PASS