Match comparison for Hubbard energy (match type 30108)

Commits > Commit 32c00845502bbc3ac64555e3c727792a7ab72a6a > Input 01-nio.01-U5-gs.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
2.120170000000000e-01 1.060000000000000e-05 2.120102250877193e-01 3.813232859975612e-07 2.120103750000000e-01 7.850000000031443e-07 PASS

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Detailed information

Reference: 0.212017, precision: 0.0000106
Run Value Difference Relative difference Status
GCI_foss_ppc_autotools: [foss2022a-serial] 2.120099600000000e-01 -7.040000000013702e-06 -6.641509433975190e-01 PASS
cmake_foss_2022a_full_serial 2.120100700000000e-01 -6.930000000016090e-06 -6.537735849071783e-01 PASS
spack_foss-2022a_ppc 2.120099600000000e-01 -7.040000000013702e-06 -6.641509433975190e-01 PASS
spack_foss-2023a_serial_opt 2.120099400000000e-01 -7.060000000003175e-06 -6.660377358493561e-01 PASS
cmake_foss_2022a_min_serial 2.120100700000000e-01 -6.930000000016090e-06 -6.537735849071783e-01 PASS
cmake_foss_2022a_min_mpi 2.120102000000000e-01 -6.800000000001249e-06 -6.415094339623820e-01 PASS
cmake_foss_2022a_full_mpi 2.120102000000000e-01 -6.800000000001249e-06 -6.415094339623820e-01 PASS
spack_foss-2022a_mpi 2.120102000000000e-01 -6.800000000001249e-06 -6.415094339623820e-01 PASS
spack_foss-2022a_mpi_min 2.120102000000000e-01 -6.800000000001249e-06 -6.415094339623820e-01 PASS
spack_foss-2022a_serial 2.120100700000000e-01 -6.930000000016090e-06 -6.537735849071783e-01 PASS
GCI_foss_min_autotools: [foss2022a-serial] 2.120100700000000e-01 -6.930000000016090e-06 -6.537735849071783e-01 PASS
GCI_foss_min_autotools: [foss2023a-serial] 2.120099400000000e-01 -7.060000000003175e-06 -6.660377358493561e-01 PASS
spack_foss-2022a_serial_min 2.120100700000000e-01 -6.930000000016090e-06 -6.537735849071783e-01 PASS
spack_foss-2023a_serial 2.120099400000000e-01 -7.060000000003175e-06 -6.660377358493561e-01 PASS
spack_foss-2023a_mpi_min 2.120107600000000e-01 -6.240000000018453e-06 -5.886792452847597e-01 PASS
spack_foss-2023a_mpi 2.120107600000000e-01 -6.240000000018453e-06 -5.886792452847597e-01 PASS
spack_foss-2023a_serial_min 2.120099400000000e-01 -7.060000000003175e-06 -6.660377358493561e-01 PASS
spack_foss-2023a_mpi_opt 2.120107600000000e-01 -6.240000000018453e-06 -5.886792452847597e-01 PASS
GCI_foss_min_autotools: [foss2023b-serial] 2.120099400000000e-01 -7.060000000003175e-06 -6.660377358493561e-01 PASS
spack_foss-2023a_serial_debug 2.120099400000000e-01 -7.060000000003175e-06 -6.660377358493561e-01 PASS
spack_foss-2023b_serial 2.120099400000000e-01 -7.060000000003175e-06 -6.660377358493561e-01 PASS
spack_foss-2023a_serial_omp 2.120095900000000e-01 -7.410000000013239e-06 -6.990566037748339e-01 PASS
GCI_foss_omp_autotools: [foss2023a-serial] 2.120095900000000e-01 -7.410000000013239e-06 -6.990566037748339e-01 PASS
spack_foss-2023a_mpi_debug 2.120107600000000e-01 -6.240000000018453e-06 -5.886792452847597e-01 PASS
GCI_foss_autotools: [foss2022a-serial] 2.120100700000000e-01 -6.930000000016090e-06 -6.537735849071783e-01 PASS
GCI_foss_opt_autotools: [foss2023a-serial] 2.120099400000000e-01 -7.060000000003175e-06 -6.660377358493561e-01 PASS
GCI_foss_autotools: [foss2023a-serial] 2.120099400000000e-01 -7.060000000003175e-06 -6.660377358493561e-01 PASS
spack_intel-2022a_serial_omp 2.120097100000000e-01 -7.290000000020891e-06 -6.877358490585747e-01 PASS
GCI_foss_autotools: [foss2023b-serial] 2.120099400000000e-01 -7.060000000003175e-06 -6.660377358493561e-01 PASS
spack_foss-2023a_mpi_omp 2.120099600000000e-01 -7.040000000013702e-06 -6.641509433975190e-01 PASS
spack_intel-2023a_serial 2.120111600000000e-01 -5.840000000006951e-06 -5.509433962270708e-01 PASS
GCI_foss_mpi_opt_autotools: [foss2023a-mpi] 2.120107600000000e-01 -6.240000000018453e-06 -5.886792452847597e-01 PASS
GCI_intel_autotools: [intel2023a-serial] 2.120111600000000e-01 -5.840000000006951e-06 -5.509433962270708e-01 PASS
GCI_intel_omp_autotools: [intel2022a-serial] 2.120097100000000e-01 -7.290000000020891e-06 -6.877358490585747e-01 PASS
spack_intel-2023a_impi 2.120102200000000e-01 -6.780000000011777e-06 -6.396226415105449e-01 PASS
GCI_intel_omp_autotools: [intel2023a-serial] 2.120104900000000e-01 -6.510000000015115e-06 -6.141509433976523e-01 PASS
GCI_foss_debug_autotools: [foss2023a-serial] 2.120099400000000e-01 -7.060000000003175e-06 -6.660377358493561e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-min] 2.120100700000000e-01 -6.930000000016090e-06 -6.537735849071783e-01 PASS
GCI_foss-cmake: [foss2022a-serial, foss-full] 2.120100700000000e-01 -6.930000000016090e-06 -6.537735849071783e-01 PASS
GCI_intel_mpi_autotools: [intel2023a-mpi] 2.120102200000000e-01 -6.780000000011777e-06 -6.396226415105449e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-min-mpi] 2.120102000000000e-01 -6.800000000001249e-06 -6.415094339623820e-01 PASS
GCI_foss_mpi_min_autotools: [foss2022a-mpi] 2.120102000000000e-01 -6.800000000001249e-06 -6.415094339623820e-01 PASS
GCI_foss_mpi_min_autotools: [foss2023a-mpi] 2.120107600000000e-01 -6.240000000018453e-06 -5.886792452847597e-01 PASS
GCI_foss-cmake: [foss2022a-mpi, foss-full-mpi] 2.120102000000000e-01 -6.800000000001249e-06 -6.415094339623820e-01 PASS
GCI_foss_mpi_autotools: [foss2022a-mpi] 2.120102000000000e-01 -6.800000000001249e-06 -6.415094339623820e-01 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-min-mpi] 2.120107600000000e-01 -6.240000000018453e-06 -5.886792452847597e-01 PASS
GCI_foss_mpi_autotools: [foss2023a-mpi] 2.120107600000000e-01 -6.240000000018453e-06 -5.886792452847597e-01 PASS
GCI_foss_mpi_debug_autotools: [foss2023a-mpi] 2.120107600000000e-01 -6.240000000018453e-06 -5.886792452847597e-01 PASS
GCI_foss_mpi_omp_autotools: [foss2023a-mpi] 2.120099600000000e-01 -7.040000000013702e-06 -6.641509433975190e-01 PASS
GCI_foss-cmake: [foss2023a-mpi, foss-full-mpi] 2.120107600000000e-01 -6.240000000018453e-06 -5.886792452847597e-01 PASS
spack_intel-2023a_serial_omp 2.120104900000000e-01 -6.510000000015115e-06 -6.141509433976523e-01 PASS
spack_intel-2022a_impi_omp 2.120104900000000e-01 -6.510000000015115e-06 -6.141509433976523e-01 PASS
spack_foss-2022a_cuda_mpi_omp 2.120108200000000e-01 -6.180000000022279e-06 -5.830188679266300e-01 PASS
GCI_intel_mpi_omp_autotools: [intel2022a-mpi] 2.120104900000000e-01 -6.510000000015115e-06 -6.141509433976523e-01 PASS
spack_foss-2022a_cuda_serial 2.120100600000000e-01 -6.940000000010826e-06 -6.547169811330968e-01 PASS
GCI_foss_cuda_autotools: [foss2022a-cuda-mpi] 2.120097500000000e-01 -7.250000000014190e-06 -6.839622641522820e-01 PASS
GCI_foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi] 2.120099400000000e-01 -7.060000000003175e-06 -6.660377358493561e-01 PASS