Input 14-quadrupole-pot.01-hydrogen-gs.inp

Commits > Commit 7ddcca10159cfd3a5f031627bc95daf6cfe3e221 > Run spack_foss-2023a_mpi_omp

Matches

Name	Value	Reference	Precision	Difference	Status
SCF convergence	1.000000000000000e+00	1.000000000000000e+00	4.000000000000000e-08	0.000000000000000e+00	PASS
Total energy	-4.897494800000000e-01	-4.897494800000000e-01	5.000000000000000e-07	0.000000000000000e+00	PASS
Eigenvalue 1	-4.897490000000000e-01	-4.897490000000000e-01	1.000000000000000e-06	0.000000000000000e+00	PASS
Eigenvalue 2	-3.753600000000000e-02	-3.753600000000000e-02	1.000000000000000e-06	0.000000000000000e+00	PASS
Eigenvalue 3	-3.753600000000000e-02	-3.753600000000000e-02	1.000000000000000e-06	0.000000000000000e+00	PASS
Eigenvalue 4	1.936000000000000e-03	1.936000000000000e-03	1.000000000000000e-06	0.000000000000000e+00	PASS
Eigenvalue 5	4.379600000000000e-02	4.379600000000000e-02	1.000000000000000e-06	0.000000000000000e+00	PASS

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