Input 04-oep.03-jellium-full_exx.inp

Commits > Commit 4ba99df89cd19114311b0fcb367f44d4f4e26fb8 > Run cuda-mpi-omp: [foss2022a-cuda-mpi]

Matches

Name	Value	Reference	Precision	Difference	Status
SCF convergence	1.000000000000000e+00	1.000000000000000e+00	1.000000000000000e-04	0.000000000000000e+00	PASS
Total energy	-3.354830300000000e-01	-3.354830800000000e-01	1.680000000000000e-07	4.999999997368221e-08	PASS
Exchange	-1.027130980000000e+00	-1.027130860000000e+00	1.320000000000000e-07	-1.199999999368373e-07	PASS
Eigenvalue 1	-2.545870000000000e-01	-2.545870000000000e-01	1.270000000000000e-05	0.000000000000000e+00	PASS
Eigenvalue 2	-1.888670000000000e-01	-1.888670000000000e-01	9.439999999999999e-06	0.000000000000000e+00	PASS

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