Input 03-xc.gga_x_pw86.inp

Commits > Commit 4ba99df89cd19114311b0fcb367f44d4f4e26fb8 > Run cuda-mpi-omp: [foss2022a-cuda-mpi]

Matches

Name	Value	Reference	Precision	Difference	Status
gga_x_pw86 Eigenvalue up	-9.730750000000000e-01	-9.731150000000000e-01	4.400000000000000e-05	3.999999999992898e-05	PASS
gga_x_pw86 Eigenvalue dn	-8.214380000000000e-01	-8.214764999999999e-01	4.230000000000000e-05	3.849999999994136e-05	PASS
gga_x_pw86 Exchange	-3.223392300000000e-01	-3.223429850000000e-01	4.130000000000000e-06	3.755000000049691e-06	PASS
gga_x_pw86 Int[n*v_xc]	-4.089180300000000e-01	-4.089226650000000e-01	5.100000000000000e-06	4.634999999975076e-06	PASS

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