Input 03-xc.gga_x_pw91.inp
Commits >
Commit 693a0d35b3d26ba3cd9b2465c2841d04084addbc >
Run cuda: [foss2022a-cuda-mpi, ci-foss-full-mpi-omp-cuda]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| gga_x_pw91 Eigenvalue up | -9.693480000000000e-01 | -9.693879999999999e-01 | 4.400000000000000e-05 | 3.999999999992898e-05 | PASS |
| gga_x_pw91 Eigenvalue dn | -8.165070000000000e-01 | -8.165445000000000e-01 | 4.130000000000000e-05 | 3.750000000002363e-05 | PASS |
| gga_x_pw91 Exchange | -3.171790000000000e-01 | -3.171825800000000e-01 | 3.940000000000000e-06 | 3.580000000003025e-06 | PASS |
| gga_x_pw91 Int[n*v_xc] | -4.049501500000000e-01 | -4.049545750000000e-01 | 4.880000000000000e-06 | 4.424999999974588e-06 | PASS |