Input 05-time_propagation.05-td_md.inp

Commits > Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e > Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi]

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -3.791009280177391e+01 -3.791009280177000e+01 1.900000000000000e-10 -3.915090474038152e-12 PASS
Energy [step 5] -3.791008856892502e+01 -3.791008856893000e+01 1.900000000000000e-10 4.980904577678302e-12 PASS
Energy [step 10] -3.791001520298098e+01 -3.791001520298000e+01 1.900000000000000e-10 -9.805489753489383e-13 PASS
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