Match comparison for Hartree-Fock external energy (match type 15656)

Commits > Commit 17b096911440bfe83ad69af07734b73ecc024f80 > Input 02-xc_2d.02-hf.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
4.529334900000000e-01 1.000000000000000e-04 4.529337700000000e-01 5.551115123125783e-17 4.529337700000000e-01 0.000000000000000e+00 PASS
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Detailed information

Reference: 0.45293349, precision: 0.0001
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_foss-2023a_serial_min 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_foss-2023a_serial_opt 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_foss-2023a_serial 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_foss-2023b_serial 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_foss-2022a_ppc 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_foss-2023a_mpi_min 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_foss-2023a_serial_debug 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_intel-2022a_serial_omp 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_foss-2023a_serial_omp 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_foss-2023a_mpi_opt 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
cmake_foss_2022a_full_mpi 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_foss-2023a_mpi 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_intel-2023a_impi 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_foss-2023a_mpi_debug 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_foss-2022a_cuda_mpi_omp 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_foss-2023a_mpi_omp 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
cmake_foss_2022a_min_serial 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
cmake_foss_2022a_full_serial 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
cmake_foss_2022a_min_mpi 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_foss-2022a_serial 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_foss-2022a_mpi_min 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_intel-2022a_impi_omp 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_intel-2023a_serial 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_foss-2022a_mpi 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_intel-2023a_serial_omp 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_foss-2023a_valgrind 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS
spack_foss-2022a_cuda_serial 4.529337700000000e-01 2.800000000191538e-07 2.800000000191538e-03 PASS