Input 02-propagators.02-cnsparskit.inp

Commits > Commit 08b73ec86c1ce3969ff61040f8f54a592910f9b6 > Run spack_foss-2022a_cuda_mpi_omp

Matches

Name Value Reference Precision Difference Status
Forces [step 1] 8.537491810749342e-02 8.537491810749601e-02 8.300000000000000e-15 -2.581268532253489e-15 PASS
Forces [step 20] 7.964818149493880e-02 7.964818149493391e-02 5.370000000000000e-15 4.884981308350689e-15 PASS
Energy [step 1] -1.060684240205382e+01 -1.060684240205380e+01 5.300000000000000e-14 -1.598721155460225e-14 PASS
Energy [step 20] -1.060634890211196e+01 -1.060634890211200e+01 5.300000000000000e-12 3.730349362740526e-14 PASS
Multipoles [step 1] -1.420711204930258e-15 2.282730401188460e-15 4.670000000000000e-15 -3.703441606118718e-15 PASS
Multipoles [step 20] -1.265308695811644e-01 -1.265308695811640e-01 6.330000000000000e-15 -4.440892098500626e-16 PASS
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