Match gga_xc_b97_d Eigenvalue up
Commits >
Commit 9972eae3cc35bad71f44bb929051f5e204f853a2 >
Run foss-mpi-min: [foss2023a-mpi] >
Input 03-xc.gga_xc_b97_d.inp
Value | Reference | Precision | Status |
-9.869170000000000e-01 | -9.868770000000000e-01 | 4.400000000000000e-05 | PASS |
Command: GREPFIELD(static/info, ' 1 up', 3)