Input 03-xc.gga_c_pbe_jrgx.inp
Commits >
Commit 705c4760eef009c58a165e8716adc8057257a566 >
Run foss_cuda_mpi_omp_autotools: [foss2022a-cuda-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| gga_c_pbe_jrgx Eigenvalue up | -5.505240000000000e-01 | -5.505610000000001e-01 | 4.070000000000000e-05 | 3.700000000006476e-05 | PASS |
| gga_c_pbe_jrgx Eigenvalue dn | -5.993300000000000e-01 | -5.993560000000000e-01 | 2.860000000000000e-05 | 2.599999999997049e-05 | PASS |
| gga_c_pbe_jrgx Correlation | -1.924423000000000e-02 | -1.924440000000000e-02 | 1.870000000000000e-07 | 1.700000000007251e-07 | PASS |
| gga_c_pbe_jrgx Int[n*v_xc] | -2.645505000000000e-02 | -2.645528500000000e-02 | 2.580000000000000e-07 | 2.350000000012065e-07 | PASS |