Match comparison for Hartree energy (match type 29030)

Commits > Commit b1773e3237a9e3fe1d68ecd7146c17ebbd95a961 > Input 16-platinum_psp8.01-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
1.021574642200000e+02 1.570000000000000e-06 1.021574654467797e+02 7.164801931557038e-07 1.021574642150000e+02 1.425000000665477e-06 PASS

Checks for this match

  • GPU builders have different values.
Loading plot...
Get updated match line Get updated match line with fixed reference

Detailed information

Reference: 102.15746422, precision: 0.00000157
Run Value Difference Relative difference Status
GCI_foss_min_autotools: [foss2023a-serial] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss_opt_autotools: [foss2023a-serial] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
cmake_foss_2022a_full_serial 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss_autotools: [foss2022a-serial] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss_autotools: [foss2023b-serial] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_foss-2023a_serial_min 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_foss-2022a_serial_min 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_foss-2022a_ppc 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_foss-2022a_serial 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_intel_omp_autotools: [intel2022a-serial] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_foss-2023a_serial 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
cmake_foss_2022a_min_mpi 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss_debug_autotools: [foss2023a-serial] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_foss-2022a_mpi_min 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_foss-2023a_mpi_min 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss_ppc_autotools: [foss2022a-serial] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
cmake_foss_2022a_full_mpi 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
cmake_foss_2022a_min_serial 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_foss-2023a_mpi_opt 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_foss-2023a_serial_debug 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_foss-2022a_mpi 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_foss-2023a_mpi 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss_min_autotools: [foss2023b-serial] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_foss-2023a_mpi_debug 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_foss-2023a_mpi_omp 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss_autotools: [foss2023a-serial] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss_min_autotools: [foss2022a-serial] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_foss-2022a_cuda_mpi_omp 1.021574627900000e+02 -1.429999997526465e-06 -9.108280239022073e-01 PASS
GCI_intel_autotools: [intel2023a-serial] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_foss-2023a_serial_opt 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss_omp_autotools: [foss2023a-serial] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_foss-2023a_serial_omp 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_foss-2023b_serial 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_intel-2023a_serial 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_intel-2022a_serial_omp 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_intel_omp_autotools: [intel2023a-serial] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_intel-2023a_serial_omp 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] 1.021574627900000e+02 -1.429999997526465e-06 -9.108280239022073e-01 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_intel-2023a_impi 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-min-mpi] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-full-mpi] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_intel-2022a_impi_omp 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_foss-2022a_cuda_serial 1.021574627900000e+02 -1.429999997526465e-06 -9.108280239022073e-01 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
spack_foss-2023a_valgrind 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS
GCI_foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 1.021574627900000e+02 -1.429999997526465e-06 -9.108280239022073e-01 PASS
GCI_foss_valgrind_autotools: [foss2023a-serial] 1.021574656400000e+02 1.420000003804489e-06 9.044586011493561e-01 PASS