Input 03-xc.lda_c_pz.inp
Commits >
Commit 3874475d54e6d4931162c1a62f5667add8f8f561 >
Run foss_cuda_autotools: [foss2022a-cuda-mpi]
Matches
Name | Value | Reference | Precision | Difference | Status |
lda_c_pz Eigenvalue up | -5.640670000000000e-01 | -5.641045000000000e-01 | 4.130000000000000e-05 | 3.750000000002363e-05 | PASS |
lda_c_pz Eigenvalue dn | -6.298020000000000e-01 | -6.298295000000000e-01 | 3.030000000000000e-05 | 2.750000000006914e-05 | PASS |
lda_c_pz Correlation | -3.787685000000000e-02 | -3.787722500000000e-02 | 4.130000000000000e-07 | 3.750000000038445e-07 | PASS |
lda_c_pz Int[n*v_xc] | -4.338427000000000e-02 | -4.338467500000000e-02 | 4.450000000000000e-07 | 4.049999999949927e-07 | PASS |