Input 03-xc.gga_c_pbe_jrgx.inp
Commits >
Commit 6099f031302cffa2938f492784ba2f7b55faffa3 >
Run intel_mpi_autotools: [intel2023a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| gga_c_pbe_jrgx Eigenvalue up | -5.505980000000000e-01 | -5.505610000000001e-01 | 4.070000000000000e-05 | -3.699999999995374e-05 | PASS |
| gga_c_pbe_jrgx Eigenvalue dn | -5.993820000000000e-01 | -5.993560000000000e-01 | 2.860000000000000e-05 | -2.599999999997049e-05 | PASS |
| gga_c_pbe_jrgx Correlation | -1.924457000000000e-02 | -1.924440000000000e-02 | 1.870000000000000e-07 | -1.699999999972557e-07 | PASS |
| gga_c_pbe_jrgx Int[n*v_xc] | -2.645552000000000e-02 | -2.645528500000000e-02 | 2.580000000000000e-07 | -2.349999999977370e-07 | PASS |