Input 02-xc_2d.gga_b86_mgc.inp
Commits >
Commit 3c86545dbb6a164adc7b03c9886fea0d0acfc59e >
Run GCI_foss_mpi_opt_autotools: [foss2023a-mpi]
Matches
| Name | Value | Reference | Precision | Difference | Status |
| GGA 2D B86 MGC eigenvalue 1 up (libxc5) | 7.612770000000000e-01 | 7.612770000000000e-01 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| GGA 2D B86 MGC eigenvalue 2 up (libxc5) | 9.398910000000000e-01 | 9.398910000000000e-01 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| GGA 2D B86 MGC eigenvalue 1 dn | 1.169397000000000e+00 | 1.169397000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| GGA 2D B86 MGC eigenvalue 2 dn | 1.224726000000000e+00 | 1.224726000000000e+00 | 1.000000000000000e-04 | 0.000000000000000e+00 | PASS |
| GGA 2D B86 MGC Exchange (libxc5) | -6.454382200000000e-01 | -6.454382100000000e-01 | 1.000000000000000e-04 | -9.999999939225290e-09 | PASS |
| GGA 2D B86 MGC Int[n*v_xc] (libxc5) | -9.529358900000000e-01 | -9.529358700000000e-01 | 1.000000000000000e-04 | -1.999999998947288e-08 | PASS |