Input 03-xc.gga_x_pw91.inp

Commits > Commit f1dbe11076ccb3bb542605fe66566061d8720041 > Run spack_foss-2023b_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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