Input 03-xc.gga_x_pbea.inp

Commits > Commit ad9fcbdd35c8d08e16e213263c476bba0afb770b > Run spack_foss-2022a_mpi

Matches

Name	Value	Reference	Precision	Difference	Status
gga_x_pbea Eigenvalue up	-9.648260000000000e-01	-9.647865000000000e-01	4.340000000000000e-05	-3.949999999997011e-05	PASS
gga_x_pbea Eigenvalue dn	-8.113300000000000e-01	-8.112925000000000e-01	4.130000000000000e-05	-3.750000000002363e-05	PASS
gga_x_pbea Exchange	-3.120151100000000e-01	-3.120116200000000e-01	3.840000000000000e-06	-3.489999999994886e-06	PASS
gga_x_pbea Int[n*v_xc]	-4.002273100000000e-01	-4.002229500000000e-01	4.800000000000000e-06	-4.360000000036557e-06	PASS

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