Input 03-xc.gga_x_pw91.inp

Commits > Commit c7ac96946c926bee5c46ca4221093c1f60753f5a > Run spack_foss-2023a_serial

Matches

Name	Value	Reference	Precision	Difference	Status
gga_x_pw91 Eigenvalue up	-9.694280000000000e-01	-9.693879999999999e-01	4.400000000000000e-05	-4.000000000004000e-05	PASS
gga_x_pw91 Eigenvalue dn	-8.165820000000000e-01	-8.165445000000000e-01	4.130000000000000e-05	-3.750000000002363e-05	PASS
gga_x_pw91 Exchange	-3.171861500000000e-01	-3.171825800000000e-01	3.940000000000000e-06	-3.570000000008289e-06	PASS
gga_x_pw91 Int[n*v_xc]	-4.049589900000000e-01	-4.049545750000000e-01	4.880000000000000e-06	-4.415000000035363e-06	PASS

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