Input 03-xc.gga_x_mpbe.inp

Commits > Commit 7368b0b20aad13e0ecfc3e36ba5b1a9f5c3d54b1 > Run spack_foss-2023a_serial_omp

Matches

Name	Value	Reference	Precision	Difference	Status
gga_x_mpbe Eigenvalue up	-9.694990000000000e-01	-9.694594999999999e-01	4.350000000000000e-05	-3.950000000008114e-05	PASS
gga_x_mpbe Eigenvalue dn	-8.182920000000000e-01	-8.182545000000000e-01	4.130000000000000e-05	-3.750000000002363e-05	PASS
gga_x_mpbe Exchange	-3.188882200000000e-01	-3.188845950000000e-01	4.000000000000000e-06	-3.625000000007095e-06	PASS
gga_x_mpbe Int[n*v_xc]	-4.053583200000000e-01	-4.053538900000000e-01	4.890000000000000e-06	-4.429999999999712e-06	PASS

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