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Uploads by Nt208

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Date Name Thumbnail Size Description Versions
12:08, 18 February 2011 Endo ts B3LYP opt+freq nt208.mol (file) 2 KB   1
10:54, 18 February 2011 ENDO nt208.mol (file) 2 KB   1
10:52, 18 February 2011 ENDO TS nt208.mol (file) 2 KB   5
10:42, 18 February 2011 Diels-Alder reaction nt208.jpg (file) 19 KB   4
10:41, 18 February 2011 Maleic reaction.jpg (file) 7 KB   3
18:46, 17 February 2011 Exo endo HOMOs nt208.jpg (file) 27 KB   1
18:40, 17 February 2011 Endo ts HOMO nt208.jpg (file) 16 KB   1
18:40, 17 February 2011 Endo ts HOMO.jpg (file) 16 KB   1
18:31, 17 February 2011 Endo ts movie nt208.gif (file) 348 KB   1
18:28, 17 February 2011 Exo ts movie nt208.gif (file) 292 KB   1
18:25, 17 February 2011 Exo ts HOMO nt208.jpg (file) 20 KB   1
17:55, 17 February 2011 EXO TS mol.mol (file) 2 KB   1
17:49, 17 February 2011 Maleic exo adduct input AM1.mol (file) 2 KB   1
17:22, 17 February 2011 DA ts LUMO nt208.jpg (file) 11 KB   3
17:18, 17 February 2011 DA ts HOMO 1 nt208.jpg (file) 10 KB   1
17:04, 17 February 2011 DA ts HOMO nt208.jpg (file) 11 KB   2
16:35, 17 February 2011 DA ts first freq.gif (file) 241 KB   1
16:32, 17 February 2011 DA ts imaginary freq.gif (file) 244 KB   1
16:10, 17 February 2011 Ethylene LUMO nt208.jpg (file) 16 KB   1
16:04, 17 February 2011 Ethylene HOMO nt208.jpg (file) 17 KB   1
16:02, 17 February 2011 Cis butadiene LUMO nt208.jpg (file) 14 KB   1
16:00, 17 February 2011 Cis butadiene HOMO nt208.jpg (file) 15 KB   1
12:55, 17 February 2011 CHAIR IRC2 100.mol (file) 2 KB   1
12:50, 17 February 2011 CHAIR IRC1 optimised.mol (file) 2 KB   1
12:48, 17 February 2011 CHAIR IRC1 incmplete.mol (file) 2 KB   1
12:27, 17 February 2011 Boat ts QST2 movie.gif (file) 242 KB   1
12:07, 17 February 2011 QST2 success setup.jpg (file) 60 KB   1
13:04, 16 February 2011 QST2 fail setup.jpg (file) 23 KB   2
12:29, 16 February 2011 CHAIR TS FROZEN mol.mol (file) 2 KB   1
12:23, 16 February 2011 Chair ts no eigen movie.gif (file) 276 KB   1
12:14, 16 February 2011 CHAIR TS NO EIGEN mol.mol (file) 2 KB   1
11:49, 16 February 2011 Transition states nt208.jpg (file) 10 KB   1
17:32, 14 February 2011 Anti2 IR nt208.jpg (file) 51 KB   1
16:02, 14 February 2011 ANTI2 DFT optimised.mol (file) 2 KB   1
15:56, 14 February 2011 ANTI2 optimised.mol (file) 2 KB   1
15:55, 14 February 2011 Anti2 before.mol (file) 2 KB   1
14:43, 14 February 2011 GAUCHE 1 5 HEXADIENE optimised.mol (file) 2 KB   1
14:41, 14 February 2011 Gauche 1 5 hexadiene before.mol (file) 2 KB   1
14:27, 14 February 2011 Anti 1 5 hexadiene optimised.mol (file) 2 KB   1
14:26, 14 February 2011 1 5 hexadiene before.mol (file) 2 KB   1
14:24, 14 February 2011 Anti 1 5 hexadiene before.mol (file) 2 KB   2
13:46, 14 February 2011 Cope rearrangement mech nt208.jpg (file) 8 KB   1
17:01, 8 February 2011 NCS complex IR.png (file) 16 KB   1
16:57, 8 February 2011 SCN complex IR.png (file) 16 KB   1
16:43, 8 February 2011 NCS complex MO.png (file) 128 KB   1
16:18, 8 February 2011 NCS complex charge.png (file) 23 KB   1
16:02, 8 February 2011 SCN complex MO.png (file) 89 KB   1
15:48, 8 February 2011 SCN complex charge.png (file) 16 KB   1
14:27, 8 February 2011 Trans (2) nt208.gif (file) 241 KB   1
14:26, 8 February 2011 Trans (1) nt208.gif (file) 241 KB   1
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