Input 03-xc.lda_c_pw.inp
Commits >
Commit 3874475d54e6d4931162c1a62f5667add8f8f561 >
Run foss_mpi_opt_autotools: [foss2023a-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
lda_c_pw Eigenvalue up | -5.657410000000000e-01 | -5.657035000000000e-01 | 4.130000000000000e-05 | -3.750000000002363e-05 | PASS |
lda_c_pw Eigenvalue dn | -6.279650000000000e-01 | -6.279380000000000e-01 | 2.970000000000000e-05 | -2.699999999999925e-05 | PASS |
lda_c_pw Correlation | -3.849634000000000e-02 | -3.849596000000000e-02 | 4.180000000000000e-07 | -3.800000000012127e-07 | PASS |
lda_c_pw Int[n*v_xc] | -4.428584000000000e-02 | -4.428543000000000e-02 | 4.510000000000000e-07 | -4.099999999992998e-07 | PASS |