Match comparison for Eigenvalues sum (match type 21421)

Commits > Commit 32c00845502bbc3ac64555e3c727792a7ab72a6a > Input 24-hartree_fock_1D.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
-4.873826427300000e+02 2.440000000000000e-07 -4.873826427300001e+02 1.136868377216160e-13 -4.873826427300000e+02 0.000000000000000e+00 PASS
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Detailed information

Reference: -487.38264273, precision: 0.000000244
Run Value Difference Relative difference Status
GCI_foss_ppc_autotools: [foss2022a-serial] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_full_serial -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_ppc -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial_opt -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_min_serial -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_min_mpi -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
cmake_foss_2022a_full_mpi -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_mpi -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_mpi_min -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_min_autotools: [foss2022a-serial] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_min_autotools: [foss2023a-serial] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2022a_serial_min -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_mpi_min -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_mpi -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial_min -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_mpi_opt -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_min_autotools: [foss2023b-serial] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial_debug -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023b_serial -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_serial_omp -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_omp_autotools: [foss2023a-serial] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_mpi_debug -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_autotools: [foss2022a-serial] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_opt_autotools: [foss2023a-serial] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_autotools: [foss2023a-serial] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2022a_serial_omp -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_autotools: [foss2023b-serial] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_mpi_omp -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2023a_serial -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_intel_autotools: [intel2023a-serial] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_intel_omp_autotools: [intel2022a-serial] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2023a_impi -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_intel_omp_autotools: [intel2023a-serial] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_debug_autotools: [foss2023a-serial] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-min-mpi] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-full-mpi] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2023a_serial_omp -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_intel-2022a_impi_omp -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
spack_foss-2023a_valgrind -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS
GCI_foss_valgrind_autotools: [foss2023a-serial] -4.873826427300000e+02 0.000000000000000e+00 0.000000000000000e+00 PASS