Uploads by Mf108
This special page shows all uploaded files.
| Date | Name | Thumbnail | Size | Description | Versions |
|---|---|---|---|---|---|
| 15:04, 12 November 2010 | Secondary orbital.png (file) |  |
59 KB | 1 | |
| 13:57, 12 November 2010 | Reaction mechanism orbitals.png (file) |  |
27 KB | 1 | |
| 16:58, 11 November 2010 | Diels alder reaction scheme.gif (file) |  |
10 KB | 1 | |
| 16:42, 11 November 2010 | Homolumo.gif (file) |  |
9 KB | 1 | |
| 15:53, 11 November 2010 | Z3 EXO TS AM1 HOMO.2.png (file) |  |
38 KB | 1 | |
| 15:52, 11 November 2010 | Z3 EXO TS AM1 HOMO.1.png (file) |  |
52 KB | 1 | |
| 15:09, 11 November 2010 | DA AM1 BOND.DERIVATIVE NOT.SET TS.mol (file) |  |
2 KB | 1 | |
| 15:02, 11 November 2010 | DA 6.31g TS 31529.mol (file) | |
2 KB | 1 | |
| 14:57, 11 November 2010 | DA bond.derivative not.set TS -956.gif (file) |  |
138 KB | 1 | |
| 14:56, 11 November 2010 | DA bond.derivative not.set. TS 147.gif (file) |  |
147 KB | 1 | |
| 12:33, 11 November 2010 | Z3 EXO TS AM1 812.gif (file) |  |
123 KB | 1 | |
| 12:32, 11 November 2010 | Z3 ENDO TS AM1 806.gif (file) |  |
377 KB | 1 | |
| 12:31, 11 November 2010 | Z3 EXO TS OPT.FREQ. AM1.mol (file) | |
2 KB | 1 | |
| 12:30, 11 November 2010 | Z3 ENDO TS OPT.FREQ. AM1.mol (file) | |
2 KB | 1 | |
| 17:20, 10 November 2010 | DA HOMO.2 TS.png (file) |  |
40 KB | 1 | |
| 17:20, 10 November 2010 | DA HOMO.1 TS.png (file) |  |
61 KB | 1 | |
| 17:18, 10 November 2010 | DA LUMO.2 TS.png (file) |  |
34 KB | 1 | |
| 17:18, 10 November 2010 | DA LUMO.1 TS.png (file) |  |
35 KB | 1 | |
| 13:55, 10 November 2010 | DA bond.derivative not.set TS.gif (file) |  |
138 KB | 1 | |
| 12:03, 10 November 2010 | DA ethylene homo.png (file) |  |
47 KB | 1 | |
| 12:02, 10 November 2010 | DA ethylene lumo.png (file) |  |
46 KB | 1 | |
| 17:55, 9 November 2010 | DA butadiene homo 2.png (file) |  |
44 KB | 1 | |
| 17:55, 9 November 2010 | DA butadiene lumo 1.png (file) |  |
52 KB | 1 | |
| 17:46, 9 November 2010 | DA butadiene lumo.png (file) |  |
52 KB | 1 | |
| 17:46, 9 November 2010 | DA butadiene homo.png (file) |  |
60 KB | 1 | |
| 15:13, 9 November 2010 | K3 boat 531 imag.vib.gif (file) |  |
119 KB | 1 | |
| 15:13, 9 November 2010 | K3 chair 566 imag.vib.gif (file) |  |
145 KB | 1 | |
| 14:53, 9 November 2010 | G3 boat opt.freq. 31254.mol (file) | |
2 KB | 1 | |
| 14:51, 9 November 2010 | G3 chair opt.freq. 31253.mol (file) | |
2 KB | 1 | |
| 13:55, 9 November 2010 | S3 IRC.calc. ALWAYS 31155.mol (file) | |
2 KB | 1 | |
| 13:55, 9 November 2010 | R3 IRC.calc. chair TS ONLY.mol (file) | |
2 KB | 1 | |
| 17:16, 8 November 2010 | S3 IRC.calc. always RMS.grad.png (file) |  |
20 KB | 1 | |
| 17:16, 8 November 2010 | S3 IRC.calc. always tot.E.png (file) |  |
18 KB | 1 | |
| 16:12, 8 November 2010 | R3 IRC.calc. RMSgrad..png (file) |  |
22 KB | 1 | |
| 16:11, 8 November 2010 | R3 IRC TOT.E curve.png (file) |  |
20 KB | 1 | |
| 15:14, 8 November 2010 | M3 TSberny chair TS movie.gif (file) |  |
145 KB | 1 | |
| 15:08, 8 November 2010 | T3 TSberny chair TS -818 movie.gjf (file) | |
713 KB | 1 | |
| 14:01, 8 November 2010 | R3 boat TS imag.freq..gif (file) |  |
138 KB | 1 | |
| 13:41, 8 November 2010 | T3 boat TS wrong.png (file) |  |
41 KB | 1 | |
| 13:24, 8 November 2010 | R3 boat TS log 31036.mol (file) | |
2 KB | 1 | |
| 13:02, 8 November 2010 | R3 boat TS imag.vib..png (file) |  |
40 KB | 1 | |
| 17:08, 7 November 2010 | T3 boat TS QST2 adjusted.opt.freqmf.mol (file) | |
2 KB | 1 | |
| 17:02, 7 November 2010 | T3 boat TS QST2 adjusted.opt.freq.mol (file) | |
2 KB | 1 | |
| 16:35, 7 November 2010 | T3 freezecoord. opt.2 chair TS.mol (file) | |
2 KB | 1 | |
| 14:10, 7 November 2010 | T3 opt.2 wrong TS.png (file) |  |
23 KB | 1 | |
| 14:05, 7 November 2010 | TSberny chair TS optfreq.mol2 (file) | |
976 bytes | 1 | |
| 16:19, 5 November 2010 | T3 chair 818 vibpic.png (file) |  |
20 KB | 1 | |
| 16:16, 5 November 2010 | M3 TSberny chair TS -818 movieMF.mng (file) | |
713 KB | 1 | |
| 16:06, 5 November 2010 | M3 TSberny chair TS -818 movie.mng (file) | |
937 KB | 1 | |
| 14:58, 5 November 2010 | T3 optimisedallyl picture.png (file) |  |
28 KB | 1 |
