Match XCrySDen geometry
Commits >
Commit e0b7240ece6c1278a2610f2d337090ca4d2c526d >
Run spack_foss-2022a_mpi >
Input 05-output.02-gs.inp
| Value | Reference | Precision | Status |
| 2.645886000000000e+00 | 2.645886000000000e+00 | 7.130000000000000e-13 | PASS |
Command: LINEFIELD(static/geometry.xsf, 2, 3)