Uploads by Ms6412
This special page shows all uploaded files.
| Date | Name | Thumbnail | Size | Description | Versions |
|---|---|---|---|---|---|
| 13:55, 18 November 2014 | Boratabenzene mls opt check correctaromaticity.mol2 (file) |  |
780 bytes | 1 | |
| 13:51, 18 November 2014 | MLS ben freq scf table.PNG (file) |  |
10 KB | 1 | |
| 13:11, 18 November 2014 | MLS Benzene opt table scf.PNG (file) |  |
9 KB | 1 | |
| 13:09, 18 November 2014 | MLS benzene opt scf molecule.mol2 (file) | |
778 bytes | 1 | |
| 15:46, 17 November 2014 | MLS Borata freqsumma.PNG (file) |  |
10 KB | 1 | |
| 15:40, 17 November 2014 | MLS Pyridinium freqsumm.PNG (file) |  |
10 KB | 1 | |
| 15:11, 17 November 2014 | MLS correcstruc pyridinium check mol.mol2 (file) | |
780 bytes | 1 | |
| 15:08, 17 November 2014 | Pyridinium summtable mls.PNG (file) |  |
10 KB | 1 | |
| 15:07, 17 November 2014 | MLS pyridinium realstruc scf charge1 mol.mol2 (file) | |
778 bytes | 1 | |
| 14:43, 17 November 2014 | Boronring mls output sturcorr scf mol.mol2 (file) | |
778 bytes | 1 | |
| 14:41, 17 November 2014 | MLS bring correctstruc scf table.PNG (file) |  |
10 KB | 1 | |
| 21:04, 16 November 2014 | MLS Ben freqsummary.PNG (file) |  |
10 KB | 2 | |
| 20:33, 16 November 2014 | MLS benzene optimisation.mol2 (file) | |
778 bytes | 1 | |
| 19:13, 14 November 2014 | MLS benzene optimisation.log (file) | |
60 KB | 1 | |
| 19:13, 14 November 2014 | MLS Benzene opt table.PNG (file) |  |
10 KB | 1 | |
| 18:52, 14 November 2014 | BH3NH3 MLS optimised.mol2 (file) | |
549 bytes | 1 | |
| 18:49, 14 November 2014 | BH3NH3 MLS Summarytable.PNG (file) |  |
10 KB | 1 | |
| 17:19, 14 November 2014 | NH3 MLS spectrum.PNG (file) |  |
11 KB | 1 | |
| 16:42, 14 November 2014 | MLS NH3 numbersNBO.PNG (file) |  |
36 KB | 1 | |
| 16:39, 14 November 2014 | MLS NH3 Chargedisttable.PNG (file) |  |
10 KB | 1 | |
| 16:26, 14 November 2014 | MLS optsumm NH3.PNG (file) |  |
10 KB | 1 | |
| 16:23, 14 November 2014 | MLS NH3 summary.PNG (file) |  |
9 KB | 1 | |
| 16:17, 14 November 2014 | MLS NH3 Opt molecule.mol2 (file) | |
349 bytes | 1 | |
| 16:15, 14 November 2014 | MLS NH3 Chargedist.PNG (file) |  |
27 KB | 1 | |
| 14:56, 14 November 2014 | MO MLS NH3 log.txt (file) |  |
60 KB | 1 | |
| 14:34, 14 November 2014 | MLS NH3 OPT.LOG (file) | |
48 KB | 1 | |
| 14:29, 14 November 2014 | MO BH3 MLS hopefullyscreenshots.png (file) |  |
275 KB | 1 | |
| 14:25, 14 November 2014 | MLS FREQ NH3 log.txt (file) | |
27 KB | 1 | |
| 14:24, 14 November 2014 | MLS freq NH3 summary.PNG (file) |  |
10 KB | 1 | |
| 13:47, 14 November 2014 | MLS BH3 MO diagram withscreenshots.png (file) |  |
183 KB | 1 | |
| 14:40, 13 November 2014 | MLS GaBr3 freq log 2.txt (file) | |
28 KB | 1 | |
| 14:29, 13 November 2014 | Supervised BH3 MLS spectrum.PNG (file) |  |
14 KB | 1 | |
| 14:16, 13 November 2014 | Supervied MLS BH3 D3h summary.PNG (file) |  |
11 KB | 1 | |
| 14:10, 13 November 2014 | SUPERVIES D3H MLS BH3 FREQ.LOG (file) | |
26 KB | 1 | |
| 13:46, 13 November 2014 | MLS GaBr3 spectrum.PNG (file) |  |
12 KB | 1 | |
| 13:04, 13 November 2014 | MLS GaBr3 freq summary.PNG (file) |  |
10 KB | 1 | |
| 12:03, 13 November 2014 | MLS BH3 IRspec.PNG (file) |  |
17 KB | 1 | |
| 11:37, 13 November 2014 | MLS GAUSSD3HCOPY FREQ AGAIN.LOG (file) | |
26 KB | 1 | |
| 11:19, 13 November 2014 | MLS d3h blanktable image.PNG (file) |  |
8 KB | 1 | |
| 16:24, 11 November 2014 | Mls BBr3 submitted opt mol.mol2 (file) | |
394 bytes | 1 | |
| 16:17, 11 November 2014 | MLS BBr3 OPT Summary.PNG (file) |  |
10 KB | 1 | |
| 15:43, 11 November 2014 | MLS GaBr3 summary.PNG (file) |  |
11 KB | 1 | |
| 15:31, 11 November 2014 | MLS GaBr3 opt mixed morekeywords mol.mol2 (file) | |
379 bytes | MLS_GaBr3_opt_m_mkw_mol | 1 |
| 17:34, 10 November 2014 | MLS BH3 OPT B631GFROM321G.LOG (file) | |
31 KB | 1 | |
| 17:31, 10 November 2014 | MLS BH3 OPT B631Gfrom321G.mol2 (file) | |
349 bytes | 1 | |
| 17:27, 10 November 2014 | BH3 631Gdp from 321G.PNG (file) |  |
12 KB | 1 | |
| 16:32, 10 November 2014 | MLS BH3 OPT BS321G REAL.LOG (file) | |
69 KB | 1 | |
| 16:12, 10 November 2014 | MLS BH3 opt BS321G real.mol2 (file) | |
349 bytes | 1 | |
| 15:44, 10 November 2014 | MLS BH3 opt summary BS321G.PNG (file) |  |
12 KB | 1 | |
| 15:08, 10 November 2014 | MLS BH3 opt summary.PNG (file) |  |
11 KB | 1 |
