Input 05-time_propagation.05-td_md.inp

Commits > Commit f1dbe11076ccb3bb542605fe66566061d8720041 > Run spack_intel-2022a_impi_omp

Matches

Name Value Reference Precision Difference Status
Energy [step 1] -3.791009280177373e+01 -3.791009280177000e+01 1.900000000000000e-10 -3.730349362740526e-12 PASS
Energy [step 5] -3.791008856892483e+01 -3.791008856893000e+01 1.900000000000000e-10 5.165645688975928e-12 PASS
Energy [step 10] -3.791001520298081e+01 -3.791001520298000e+01 1.900000000000000e-10 -8.100187187665142e-13 PASS
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