Input 23-go-na2.04-fire_restart.inp

Commits > Commit 57f8ca8d342504024fed98c8f4356f69f5870627 > Run cuda-serial: [foss2022a-cuda-mpi]

Matches

Name	Value	Reference	Precision	Difference	Status
Total energy	-4.177694000000000e-01	-4.177694000000000e-01	2.090000000000000e-06	0.000000000000000e+00	PASS
Force [1]	5.221468150000000e-05	5.221468149999999e-05	5.220000000000000e-19	6.776263578034403e-21	PASS
Force [2]	-5.221468150000000e-05	-5.221468149999999e-05	5.220000000000000e-19	-6.776263578034403e-21	PASS
Geometry [1]	-1.465628000000000e+00	-1.465628000000000e+00	7.330000000000000e-06	0.000000000000000e+00	PASS
Geometry [2]	1.465628000000000e+00	1.465628000000000e+00	7.330000000000000e-06	0.000000000000000e+00	PASS

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