Uploads by Hc3014
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| Date | Name | Thumbnail | Size | Description | Versions |
|---|---|---|---|---|---|
| 19:55, 20 October 2016 | QH vs MD.png (file) | 38 KB | 1 | ||
| 19:20, 20 October 2016 | Harmonic approx.png (file) | 22 KB | 1 | ||
| 18:42, 20 October 2016 | MDvolvstemp.png (file) | 34 KB | 1 | ||
| 16:45, 18 October 2016 | VolvsTempcurve.png (file) | 43 KB | 1 | ||
| 16:09, 18 October 2016 | VolvsTemp.png (file) | 42 KB | 1 | ||
| 16:02, 18 October 2016 | LCvsTemp.png (file) | 42 KB | 1 | ||
| 16:00, 18 October 2016 | Free energy vs temp.png (file) | 30 KB | 1 | ||
| 15:53, 18 October 2016 | DOStates32.png (file) | 10 KB | 1 | ||
| 15:53, 18 October 2016 | DOStates16.png (file) | 11 KB | 1 | ||
| 15:53, 18 October 2016 | DOStates8.png (file) | 7 KB | 1 | ||
| 15:52, 18 October 2016 | DOStates4.png (file) | 7 KB | 1 | ||
| 15:48, 18 October 2016 | DOStates2.png (file) | 6 KB | 1 | ||
| 15:46, 18 October 2016 | DOStates1.png (file) | 6 KB | 1 | ||
| 16:19, 13 May 2016 | HC NICL2DHPE CIS SQPL2631GFA.LOG (file) | 933 KB | NiCldHpe cissqplanar frequency and pop analysis 613G (d) | 1 | |
| 16:13, 13 May 2016 | HC NICL2DHPE CIS SQPL2631GOPT.LOG (file) | 321 KB | NiCl2dHpe cis sqplanar optimization 631G (d) | 1 | |
| 15:57, 13 May 2016 | HC NICL2DHPE CIS SQPL2FINAL.LOG (file) | 333 KB | NiCl2dHpe cis sqplanar optimization 321G | 1 | |
| 15:47, 13 May 2016 | HC NICL2DHPE CIS SQPL2.LOG (file) | 780 KB | NiCl2dHpe cis sqpl 321G optimization | 1 | |
| 15:46, 13 May 2016 | HC NICL2DHPE TET 631GFA.LOG (file) | 1.59 MB | NiCl2dHpe tet 631G (d) frequency and population analysis | 1 | |
| 15:45, 13 May 2016 | HC NICL2DHPE TET 631GOPT.LOG (file) | 249 KB | NiCl2dHpe tet 631G (d) optimization | 1 | |
| 15:44, 13 May 2016 | HC NICL2DHPE TET.LOG (file) | 316 KB | NiCl2dHpe tet 321G optimization | 1 | |
| 15:39, 13 May 2016 | HC NiCl2dHpe tet 631GFA.gjf (file) | 1 KB | NiCldHpe tetrahedral frequency analysis and population 631G (d) | 1 | |
| 15:23, 13 May 2016 | HC NiCl2dHpe tet 631Gopt.gjf (file) | 1 KB | NiCl2dHpe, tetrahedral optimization basis set=631G (d) | 1 | |
| 15:22, 13 May 2016 | HC NiCl2dHpe tet 321Gopt.gjf (file) | 1 KB | NiCl2dHpe, tetrahedral, optimization basis set=321G | 1 |