Input 03-xc.gga_x_xpbe.inp
Commits >
Commit 16a288d93f4684890591c6dab8ffeadb82c84e9a >
Run foss_cmake: [foss2022a-serial, foss-full]
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 |