Input 05-time_propagation.05-td_md.inp

Commits > Commit f1dbe11076ccb3bb542605fe66566061d8720041 > Run spack_foss-2023a_serial_omp

Matches

Name	Value	Reference	Precision	Difference	Status
Energy [step 1]	-3.791009280177389e+01	-3.791009280177000e+01	1.900000000000000e-10	-3.886668764607748e-12	PASS
Energy [step 5]	-3.791008856892499e+01	-3.791008856893000e+01	1.900000000000000e-10	5.009326287108706e-12	PASS
Energy [step 10]	-3.791001520298097e+01	-3.791001520298000e+01	1.900000000000000e-10	-9.734435479913373e-13	PASS

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