Input 03-xc.lda_c_pw.inp
Commits >
Commit 6dda27ed08cd9fd2b2f861e6109ead2bd6d3cd56 >
Run foss_cuda_autotools: [foss2022a-cuda-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
lda_c_pw Eigenvalue up | -5.656660000000000e-01 | -5.657035000000000e-01 | 4.130000000000000e-05 | 3.750000000002363e-05 | PASS |
lda_c_pw Eigenvalue dn | -6.279110000000000e-01 | -6.279380000000000e-01 | 2.970000000000000e-05 | 2.699999999999925e-05 | PASS |
lda_c_pw Correlation | -3.849558000000000e-02 | -3.849596000000000e-02 | 4.180000000000000e-07 | 3.799999999942738e-07 | PASS |
lda_c_pw Int[n*v_xc] | -4.428501000000000e-02 | -4.428543000000000e-02 | 4.510000000000000e-07 | 4.200000000009751e-07 | PASS |