Input 03-xc.gga_x_pbea.inp

Commits > Commit 3f3300a09a325083399ad405019c399609c6d1c2 > Run cuda-serial: [foss2022a-cuda-mpi]

Matches

Name	Value	Reference	Precision	Difference	Status
gga_x_pbea Eigenvalue up	-9.521720000000000e-01	-9.647865000000000e-01	4.340000000000000e-05	1.261449999999997e-02	FAIL
gga_x_pbea Eigenvalue dn	-4.864720000000000e-01	-8.112925000000000e-01	4.130000000000000e-05	3.248205000000000e-01	FAIL
gga_x_pbea Exchange	0.000000000000000e+00	-3.120116200000000e-01	3.840000000000000e-06	3.120116200000000e-01	FAIL
gga_x_pbea Int[n*v_xc]	0.000000000000000e+00	-4.002229500000000e-01	4.800000000000000e-06	4.002229500000000e-01	FAIL

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