Input 01-xc_1d.oep_kli.inp

Commits > Commit 8520a932a983b5c1584256e5aef0dad9a7dbc2f2 > Run cmake_foss_2022a_full_serial

Matches

Name Value Reference Precision Difference Status
OEP KLI Eigenvalue 1 up -9.488770000000000e-01 -9.488770000000000e-01 4.740000000000000e-05 0.000000000000000e+00 PASS
OEP KLI Eigenvalue 2 up -3.155080000000000e-01 -3.155080000000000e-01 1.580000000000000e-05 0.000000000000000e+00 PASS
OEP KLI Eigenvalue 1 dn -1.071001000000000e+00 -1.071001000000000e+00 5.360000000000000e-06 0.000000000000000e+00 PASS
OEP KLI Eigenvalue 2 dn -2.223400000000000e-02 -2.225400000000000e-02 3.630000000000000e-05 1.999999999999919e-05 PASS
OEP KLI Exchange -1.077178300000000e+00 -1.077178280000000e+00 1.100000000000000e-03 -1.999999987845058e-08 PASS
OEP KLI Int[n*v_xc] -1.977045110000000e+00 -1.977045130000000e+00 1.100000000000000e-03 2.000000010049519e-08 PASS
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