Input 01-propagators.05-etrs_chebyshev.inp

Commits > Commit 332f9cd714e196a805e42e2741bfb36d81a9f700 > Run foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi]

Matches

Name Value Reference Precision Difference Status
Energy [step 0] -1.060686608766762e+01 -1.060686608766761e+01 1.060000000000000e-13 -7.105427357601002e-15 PASS
Energy [step 20] -1.060638479805075e+01 -1.060638479805075e+01 1.060000000000000e-13 -1.776356839400250e-15 PASS
Multipoles [step 0] -3.510011190391033e-15 0.000000000000000e+00 1.000000000000000e-14 -3.510011190391033e-15 PASS
Multipoles [step 20] -1.269180738429657e-01 -1.269180738429604e-01 1.000000000000000e-14 -5.301314942585122e-15 PASS
Forces [step 0] 8.537673799432888e-02 8.537673799433310e-02 1.000000000000000e-14 -4.218847493575595e-15 PASS
Forces [step 20] 7.982464236113263e-02 7.982464236112929e-02 1.000000000000000e-14 3.330669073875470e-15 PASS
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