Input 03-xc.gga_x_g96.inp

Commits > Commit 3f59639a2c09960e9ce8b923e2789a20396f5ecf > Run spack_foss-2022a_cuda_serial

Matches

Name	Value	Reference	Precision	Difference	Status
gga_x_g96 Eigenvalue up	-9.721070000000001e-01	-9.721465000000000e-01	4.340000000000000e-05	3.949999999997011e-05	PASS
gga_x_g96 Eigenvalue dn	-8.221320000000000e-01	-8.221695000000000e-01	4.130000000000000e-05	3.750000000002363e-05	PASS
gga_x_g96 Exchange	-3.265456300000000e-01	-3.265492950000000e-01	4.020000000000000e-06	3.665000000041552e-06	PASS
gga_x_g96 Int[n*v_xc]	-4.082820500000000e-01	-4.082864750000000e-01	4.850000000000000e-06	4.425000000030099e-06	PASS

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