Match gga_x_g96 Eigenvalue up
Commits >
Commit a207e10cd726e9ee7bae9ea565d18a80e5fdcb20 >
Run foss-mpi-debug: [foss2023a-mpi] >
Input 03-xc.gga_x_g96.inp
Value | Reference | Precision | Status |
-9.721860000000000e-01 | -9.721465000000000e-01 | 4.340000000000000e-05 | PASS |
Command: GREPFIELD(static/info, ' 1 up', 3)