Input 03-xc.gga_c_pbe.inp

Commits > Commit 23cadfdc08b3b148a9c434cb52e4be78ff32991e > Run intel_omp_autotools: [intel2022a-serial]

Matches

Name Value Reference Precision Difference Status
gga_c_pbe Eigenvalue up -5.460620000000000e-01 -5.460245000000000e-01 4.130000000000000e-05 -3.750000000002363e-05 PASS
gga_c_pbe Eigenvalue dn -5.892670000000000e-01 -5.892410000000000e-01 2.860000000000000e-05 -2.599999999997049e-05 PASS
gga_c_pbe Correlation -1.453942000000000e-02 -1.453929500000000e-02 1.380000000000000e-07 -1.250000000001250e-07 PASS
gga_c_pbe Int[n*v_xc] -2.080348000000000e-02 -2.080331000000000e-02 1.870000000000000e-07 -1.700000000007251e-07 PASS
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