Input 03-xc.gga_x_xpbe.inp
Commits >
Commit 3874475d54e6d4931162c1a62f5667add8f8f561 >
Run foss_opt_autotools: [foss2023a-serial]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| gga_x_xpbe Eigenvalue up | -9.711850000000000e-01 | -9.711455000000000e-01 | 4.340000000000000e-05 | -3.949999999997011e-05 | PASS |
| gga_x_xpbe Eigenvalue dn | -8.199510000000000e-01 | -8.199130000000000e-01 | 4.180000000000000e-05 | -3.799999999998249e-05 | PASS |
| gga_x_xpbe Exchange | -3.207306300000000e-01 | -3.207269800000000e-01 | 4.040000000000000e-06 | -3.650000000021691e-06 | PASS |
| gga_x_xpbe Int[n*v_xc] | -4.070388800000000e-01 | -4.070344200000000e-01 | 4.930000000000000e-06 | -4.459999999983921e-06 | PASS |