Input 03-xc.gga_x_optx.inp

Commits > Commit 08b73ec86c1ce3969ff61040f8f54a592910f9b6 > Run spack_foss-2022a_ppc

Matches

Name Value Reference Precision Difference Status
gga_x_optx Eigenvalue up -9.754010000000000e-01 -9.753615000000000e-01 4.340000000000000e-05 -3.949999999997011e-05 PASS
gga_x_optx Eigenvalue dn -8.255000000000000e-01 -8.254625000000000e-01 4.130000000000000e-05 -3.750000000002363e-05 PASS
gga_x_optx Exchange -3.283290000000000e-01 -3.283253150000000e-01 4.080000000000000e-06 -3.684999999975513e-06 PASS
gga_x_optx Int[n*v_xc] -4.115215900000000e-01 -4.115172800000000e-01 4.760000000000000e-06 -4.310000000007363e-06 PASS
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