Input 03-xc.gga_c_pw91.inp
Commits >
Commit 3c5618978387ff506850febf67c434621a2adfa2 >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| gga_c_pw91 Eigenvalue up | -5.468620000000000e-01 | -5.468995000000000e-01 | 4.130000000000000e-05 | 3.750000000002363e-05 | PASS |
| gga_c_pw91 Eigenvalue dn | -5.909110000000000e-01 | -5.909370000000000e-01 | 2.860000000000000e-05 | 2.600000000008151e-05 | PASS |
| gga_c_pw91 Correlation | -1.535877000000000e-02 | -1.535891500000000e-02 | 1.600000000000000e-07 | 1.450000000000062e-07 | PASS |
| gga_c_pw91 Int[n*v_xc] | -2.184193000000000e-02 | -2.184213000000000e-02 | 2.200000000000000e-07 | 2.000000000022817e-07 | PASS |