Mercurial > repos > muon-spectroscopy-computational-project > pm_muairss_write
comparison test-data/Si.xyz @ 0:0679aeb7cefc draft
planemo upload for repository https://github.com/muon-spectroscopy-computational-project/muon-galaxy-tools/main/pm_muairss_write commit d130cf2c46d933fa9d0214ddbd5ddf860f322dc4
| author | muon-spectroscopy-computational-project |
|---|---|
| date | Thu, 25 Aug 2022 16:19:08 +0000 |
| parents | |
| children |
comparison
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| -1:000000000000 | 0:0679aeb7cefc |
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| 1 8 | |
| 2 Generated by cif2cell 2.0.0. : Kitano, A. et al., Physical Review, Serie 3. B - Condensed Matter (18,1978-) 64, 0452061-0452069 (2001). | |
| 3 Si 0.000000000000000 0.000000000000000 0.000000000000000 | |
| 4 Si 4.035750000000000 4.035750000000000 1.345250000000000 | |
| 5 Si 2.690500000000000 0.000000000000000 2.690500000000000 | |
| 6 Si 4.035750000000000 1.345250000000000 4.035750000000000 | |
| 7 Si 0.000000000000000 2.690500000000000 2.690500000000000 | |
| 8 Si 1.345250000000000 1.345250000000000 1.345250000000000 | |
| 9 Si 1.345250000000000 4.035750000000000 4.035750000000000 | |
| 10 Si 2.690500000000000 2.690500000000000 0.000000000000000 |