Input 03-xc.lda_c_ob_pw.inp

Commits > Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc > Run cuda: [foss2022a-cuda-mpi, ci-foss-full-cuda]

Matches

Name Value Reference Precision Difference Status
lda_c_ob_pw Eigenvalue up -5.642330000000000e-01 -5.642700000000000e-01 4.070000000000000e-05 3.700000000006476e-05 PASS
lda_c_ob_pw Eigenvalue dn -6.260810000000000e-01 -6.261080000000000e-01 2.970000000000000e-05 2.699999999999925e-05 PASS
lda_c_ob_pw Correlation -3.723083000000000e-02 -3.723119499999999e-02 4.010000000000000e-07 3.649999999952303e-07 PASS
lda_c_ob_pw Int[n*v_xc] -4.277252000000000e-02 -4.277292500000000e-02 4.450000000000000e-07 4.050000000019316e-07 PASS
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