Match comparison for Tot. Maxwell energy [step 300] (match type 20979)

Commits > Commit 7a2cd2a0801cf0c9aaf759ff5aac90b0fe91b5f6 > Input 12-tddft-currents-to-maxwell.04-benzene-mxll-td-full-min-coup.inp

General information

Reference Precision Mean Standard deviation Midpoint Half width Status
1.401719509977955e-06 1.000000000000000e-12 1.401719509977998e-06 4.914570636266899e-20 1.401719509977995e-06 7.528005318722594e-20 PASS
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Detailed information

Reference: 0.0000014017195099779552, precision: 0.000000000001
Run Value Difference Relative difference Status
spack_foss-2022a_serial_min 1.401719509978033e-06 7.750351467376848e-20 7.750351467376848e-08 PASS
cmake_foss_2022a_full_serial 1.401719509978033e-06 7.750351467376848e-20 7.750351467376848e-08 PASS
spack_foss-2022a_serial 1.401719509978033e-06 7.750351467376848e-20 7.750351467376848e-08 PASS
spack_foss-2022a_ppc 1.401719509978052e-06 9.677351422380381e-20 9.677351422380381e-08 PASS
spack_foss-2023a_mpi_min 1.401719509977920e-06 -3.536362554786704e-20 -3.536362554786704e-08 PASS
cmake_foss_2022a_min_serial 1.401719509978033e-06 7.750351467376848e-20 7.750351467376848e-08 PASS
spack_foss-2022a_mpi_min 1.401719509977920e-06 -3.536362554786704e-20 -3.536362554786704e-08 PASS
spack_foss-2023a_mpi 1.401719509977920e-06 -3.536362554786704e-20 -3.536362554786704e-08 PASS
cmake_foss_2022a_full_mpi 1.401719509977920e-06 -3.536362554786704e-20 -3.536362554786704e-08 PASS
spack_foss-2022a_mpi 1.401719509977920e-06 -3.536362554786704e-20 -3.536362554786704e-08 PASS
cmake_foss_2022a_min_mpi 1.401719509977995e-06 3.959879028413854e-20 3.959879028413854e-08 PASS
spack_foss-2022a_cuda_mpi_omp 1.401719509978007e-06 5.188076801932590e-20 5.188076801932590e-08 PASS
spack_foss-2023a_mpi_debug 1.401719509977920e-06 -3.536362554786704e-20 -3.536362554786704e-08 PASS
spack_foss-2023a_serial 1.401719509978033e-06 7.750351467376848e-20 7.750351467376848e-08 PASS
spack_foss-2023a_mpi_opt 1.401719509977920e-06 -3.536362554786704e-20 -3.536362554786704e-08 PASS
spack_foss-2022a_cuda_serial 1.401719509978014e-06 5.908054807098745e-20 5.908054807098745e-08 PASS
spack_foss-2023a_serial_debug 1.401719509978033e-06 7.750351467376848e-20 7.750351467376848e-08 PASS
spack_foss-2023a_serial_min 1.401719509978033e-06 7.750351467376848e-20 7.750351467376848e-08 PASS
spack_foss-2023a_serial_opt 1.401719509978033e-06 7.750351467376848e-20 7.750351467376848e-08 PASS
spack_foss-2023a_mpi_omp 1.401719509978070e-06 1.151964808265848e-19 1.151964808265848e-07 PASS
spack_foss-2023b_serial 1.401719509978033e-06 7.750351467376848e-20 7.750351467376848e-08 PASS
spack_foss-2023a_serial_omp 1.401719509978002e-06 4.637505386217294e-20 4.637505386217294e-08 PASS
spack_intel-2023a_serial 1.401719509978051e-06 9.529120656610879e-20 9.529120656610879e-08 PASS
spack_intel-2022a_serial_omp 1.401719509978010e-06 5.505714157152952e-20 5.505714157152952e-08 PASS
spack_intel-2023a_serial_omp 1.401719509978010e-06 5.505714157152952e-20 5.505714157152952e-08 PASS
spack_intel-2023a_impi 1.401719509977993e-06 3.748120791600279e-20 3.748120791600279e-08 PASS
spack_intel-2022a_impi_omp 1.401719509977999e-06 4.404571325722362e-20 4.404571325722362e-08 PASS