Input 03-xc.lda_c_pw_mod.inp

Commits > Commit 995bec41f97239ed4859b75e5397558b96cd16ab > Run spack_foss-2022a_cuda_serial

Matches

Name Value Reference Precision Difference Status
lda_c_pw_mod Eigenvalue up -5.656660000000000e-01 -5.657035000000000e-01 4.130000000000000e-05 3.750000000002363e-05 PASS
lda_c_pw_mod Eigenvalue dn -6.279110000000000e-01 -6.279380000000000e-01 2.970000000000000e-05 2.699999999999925e-05 PASS
lda_c_pw_mod Correlation -3.849550000000000e-02 -3.849588000000000e-02 4.180000000000000e-07 3.799999999942738e-07 PASS
lda_c_pw_mod Int[n*v_xc] -4.428491000000000e-02 -4.428532500000000e-02 4.570000000000000e-07 4.150000000036069e-07 PASS
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