Input 03-xc.gga_c_xpbe.inp

Commits > Commit db5a37a45dcf968be97880dd1f5766f32ce63f3a > Run foss-cmake-zen4: [foss2023a-mpi, foss-min-mpi]

Matches

Name Value Reference Precision Difference Status
gga_c_xpbe Eigenvalue up -5.456950000000000e-01 -5.456575000000000e-01 4.130000000000000e-05 -3.750000000002363e-05 PASS
gga_c_xpbe Eigenvalue dn -5.878450000000000e-01 -5.878190000000000e-01 2.860000000000000e-05 -2.599999999997049e-05 PASS
gga_c_xpbe Correlation -1.404658000000000e-02 -1.404643000000000e-02 1.650000000000000e-07 -1.500000000008439e-07 PASS
gga_c_xpbe Int[n*v_xc] -2.022489000000000e-02 -2.022469000000000e-02 2.200000000000000e-07 -1.999999999988122e-07 PASS
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