Match XCrySDen geometry
Commits >
Commit adb0a770f40b5954f8a07de2fe2e63c9718fe526 >
Run spack_foss-2022a_serial >
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)