Input 02-xc_2d.gga_b86.inp

Commits > Commit 3f59639a2c09960e9ce8b923e2789a20396f5ecf > Run spack_foss-2022a_serial

Matches

Name Value Reference Precision Difference Status
GGA 2D B86 eigenvalue 1 up 7.583780000000000e-01 7.583780000000000e-01 1.000000000000000e-04 0.000000000000000e+00 PASS
GGA 2D B86 eigenvalue 2 up 9.346580000000000e-01 9.346580000000000e-01 1.000000000000000e-04 0.000000000000000e+00 PASS
GGA 2D B86 eigenvalue 1 dn 1.169397000000000e+00 1.169397000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
GGA 2D B86 eigenvalue 2 dn 1.224726000000000e+00 1.224726000000000e+00 1.000000000000000e-04 0.000000000000000e+00 PASS
GGA 2D B86 Exchange -6.656899400000000e-01 -6.656903500000000e-01 1.000000000000000e-04 4.099999999507276e-07 PASS
GGA 2D B86 Int[n*v_xc] -9.610693200000000e-01 -9.610695700000000e-01 1.000000000000000e-04 2.500000000349445e-07 PASS
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