Uploads by Jd1910
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This special page shows all uploaded files.
Date | Name | Thumbnail | Size | Description | Versions |
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12:42, 5 February 2013 | FREQ SUMMARY ENVELOPE TS2.jpg (file) | ![]() |
23 KB | 1 | |
12:31, 5 February 2013 | DFT OPT Envelope summary.jpg (file) | ![]() |
21 KB | 1 | |
12:30, 5 February 2013 | DFT OPT Envelope.jpg (file) | ![]() |
67 KB | 1 | |
12:22, 5 February 2013 | FREQ SUMMARY ENVELOPE TS1.jpg (file) | ![]() |
24 KB | 1 | |
12:21, 5 February 2013 | TS VIB1.gif (file) | ![]() |
476 KB | 1 | |
10:51, 5 February 2013 | AM1 OPT Envelope summary.jpg (file) | ![]() |
19 KB | 1 | |
10:50, 5 February 2013 | AM1 OPT Envelope.jpg (file) | ![]() |
61 KB | 2 | |
16:29, 4 February 2013 | Ethene MO diagram.png (file) | ![]() |
192 KB | 1 | |
16:20, 4 February 2013 | Butdiene MO diagram.png (file) | ![]() |
123 KB | 1 | |
16:07, 4 February 2013 | ETHENE LUMO.jpg (file) | ![]() |
116 KB | 1 | |
16:06, 4 February 2013 | ETHENE HOMO.jpg (file) | ![]() |
128 KB | 1 | |
16:06, 4 February 2013 | Cis-Butadiene LUMO.jpg (file) | ![]() |
97 KB | 1 | |
16:05, 4 February 2013 | Cis-Butadiene HOMO.jpg (file) | ![]() |
105 KB | 1 | |
15:55, 4 February 2013 | OPT BUTADIENE SUMMARY.jpg (file) | ![]() |
22 KB | 1 | |
15:54, 4 February 2013 | OPT BUTADIENE.jpg (file) | ![]() |
50 KB | 1 | |
15:52, 4 February 2013 | OPT ETHENE SUMMARY.jpg (file) | ![]() |
22 KB | 1 | |
15:50, 4 February 2013 | OPT ETHENE.jpg (file) | ![]() |
50 KB | 1 | |
12:12, 4 February 2013 | BOAT TS VIBRATIONS.gif (file) | ![]() |
495 KB | 1 | |
11:55, 4 February 2013 | HIGHER BOAT TO USE SUMMARY.jpg (file) | ![]() |
23 KB | 1 | |
11:53, 4 February 2013 | HIGHER BOAT TO USE.jpg (file) | ![]() |
64 KB | 1 | |
18:03, 3 February 2013 | Diels-alder reaction.jpg (file) | ![]() |
16 KB | 2 | |
15:31, 3 February 2013 | Gauche hexadiene OPTIMAL.mol2 (file) | ![]() |
983 bytes | 1 | |
15:29, 3 February 2013 | Gauche optimaL SUMMARY.jpg (file) | ![]() |
23 KB | 1 | |
15:00, 3 February 2013 | CHAIR IRC METHOD3.log (file) | ![]() |
439 KB | 1 | |
15:00, 3 February 2013 | CHAIR IRC METHOD2.log (file) | ![]() |
454 KB | 1 | |
14:55, 3 February 2013 | IRC coorinate chair.jpg (file) | ![]() |
120 KB | 3 | |
14:27, 3 February 2013 | 3d pes.gif (file) | ![]() |
41 KB | 1 | |
12:03, 3 February 2013 | NewmanProjections.jpg (file) | ![]() |
13 KB | 1 | |
15:55, 1 February 2013 | CHAIR METHOD2 summary.jpg (file) | ![]() |
20 KB | 1 | |
15:54, 1 February 2013 | CHAIR METHOD2.jpg (file) | ![]() |
47 KB | 1 | |
12:31, 1 February 2013 | BOAT HIGHER OPT STRUCTURE.jpg (file) | ![]() |
53 KB | 2 | |
12:24, 1 February 2013 | BOAT HIGHER OPT STRUCTURE SUMMRY.jpg (file) | ![]() |
22 KB | 1 | |
12:11, 1 February 2013 | HIGHER OPT BOAT SUMMARY.jpg (file) | ![]() |
20 KB | 1 | |
17:07, 31 January 2013 | CHAIR METHOD3 summary.jpg (file) | ![]() |
20 KB | 1 | |
17:06, 31 January 2013 | CHAIR METHOD3.jpg (file) | ![]() |
49 KB | 1 | |
16:23, 31 January 2013 | Imaginary vibration of higher opt chair.gif (file) | ![]() |
488 KB | 1 | |
16:11, 31 January 2013 | HIGHER OPT CHAIR SUMMARY.jpg (file) | ![]() |
22 KB | 1 | |
16:10, 31 January 2013 | HIGHER OPT CHAIR.jpg (file) | ![]() |
69 KB | 2 | |
15:20, 31 January 2013 | CHAIR IRC FIRSTRUN.jpg (file) | ![]() |
46 KB | 1 | |
14:56, 31 January 2013 | Imaginary vibration boat ts.gif (file) | ![]() |
470 KB | 1 | |
14:18, 31 January 2013 | Chair opt TS guess.mol2 (file) | ![]() |
972 bytes | 2 | |
13:57, 31 January 2013 | Chair ts guess opt freeze +gurtheropt.mol2 (file) | ![]() |
976 bytes | 1 | |
13:56, 31 January 2013 | Chair FREEZE opt 1 summary2.jpg (file) | ![]() |
23 KB | 1 | |
13:32, 31 January 2013 | Boat OPT 2.mol2 (file) | ![]() |
972 bytes | 1 | |
13:31, 31 January 2013 | Boat OPT 2 summary.jpg (file) | ![]() |
20 KB | 1 | |
13:18, 31 January 2013 | Boat OPT 1 summary.jpg (file) | ![]() |
24 KB | 1 | |
13:15, 31 January 2013 | Boat OPT 1.jpg (file) | ![]() |
66 KB | 1 | |
11:47, 31 January 2013 | Chair FREEZE opt 1.jpg (file) | ![]() |
68 KB | 2 | |
16:49, 29 January 2013 | Chair FREEZE opt 1 summary.jpg (file) | ![]() |
20 KB | 1 | |
15:43, 29 January 2013 | Imaginary vibration gues chair ts.gif (file) | ![]() |
500 KB | 1 |