Uploads by Ya2012
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This special page shows all uploaded files.
Date | Name | Thumbnail | Size | Description | Versions |
---|---|---|---|---|---|
10:28, 19 December 2014 | NME4 FREQ summary ya.JPG (file) | 40 KB | 2 | ||
09:29, 19 December 2014 | NME3CN LUMO.JPG (file) | 15 KB | 1 | ||
09:29, 19 December 2014 | NME3CN HOMO.JPG (file) | 14 KB | 1 | ||
09:28, 19 December 2014 | LUMO NME3CH2OH.JPG (file) | 13 KB | 1 | ||
09:27, 19 December 2014 | HOMO NME3CH2OH.JPG (file) | 15 KB | 1 | ||
09:25, 19 December 2014 | LUMO NME4 ya.JPG (file) | 16 KB | 1 | ||
09:24, 19 December 2014 | HOMO NME4 ya.JPG (file) | 15 KB | 1 | ||
09:03, 19 December 2014 | IR spectrum NME4 ya.JPG (file) | 44 KB | 1 | ||
03:32, 19 December 2014 | Orbital5 ya.png (file) | ![]() |
31 KB | 1 | |
03:31, 19 December 2014 | Orbita4 ya.png (file) | ![]() |
30 KB | 1 | |
03:30, 19 December 2014 | Orbital3 ya.png (file) | ![]() |
32 KB | 1 | |
03:29, 19 December 2014 | Orbital2 ya.png (file) | ![]() |
29 KB | 1 | |
03:28, 19 December 2014 | Orbital 1 ya.png (file) | ![]() |
23 KB | 1 | |
02:53, 19 December 2014 | NME3CH2OH charge distribution colours.JPG (file) | 15 KB | 2 | ||
02:41, 19 December 2014 | NME3CH2OH charge distribution.JPG (file) | 25 KB | 2 | ||
02:34, 19 December 2014 | Table ya NME3CH2YA.JPG (file) | 32 KB | 1 | ||
01:34, 19 December 2014 | NME3CN numbers ya.JPG (file) | 28 KB | 1 | ||
01:32, 19 December 2014 | NME3CN table ya.JPG (file) | 31 KB | 1 | ||
01:31, 19 December 2014 | NME3CN colour ya.JPG (file) | 22 KB | 1 | ||
18:46, 18 December 2014 | WRONGFREQ SUMMARY YA.JPG (file) | 42 KB | 1 | ||
18:35, 18 December 2014 | Opt NME3CH2OH wrong yaMOL.mol2 (file) | ![]() |
1 KB | 1 | |
18:34, 18 December 2014 | Summary wrongOPT ya.JPG (file) | 41 KB | 1 | ||
18:16, 18 December 2014 | Summary NME3CN ya.JPG (file) | 41 KB | 1 | ||
18:09, 18 December 2014 | NME3CH2OH FINALOPT MOL.mol2 (file) | ![]() |
1 KB | 1 | |
18:06, 18 December 2014 | Final OPT NME3CH2OH ya.JPG (file) | 41 KB | 1 | ||
13:44, 18 December 2014 | NME3CN FREQ YA SUMMARY.JPG (file) | 39 KB | 1 | ||
13:27, 18 December 2014 | NME3CN smmary ya.JPG (file) | 40 KB | 1 | ||
13:26, 18 December 2014 | LOGNME3CN OPT YA.mol2 (file) | ![]() |
1 KB | 1 | |
11:23, 18 December 2014 | IR SPECTRUM YA SME3.JPG (file) | 50 KB | 1 | ||
00:44, 18 December 2014 | FREQ SME3 ya.log (file) | ![]() |
62 KB | 1 | |
00:41, 18 December 2014 | FREQ LOG SME3 ya.JPG (file) | 42 KB | 1 | ||
00:35, 18 December 2014 | GaBr3 FREQ summary ya.JPG (file) | 41 KB | 2 | ||
00:14, 18 December 2014 | OPT LOG SME3 ya.log (file) | ![]() |
133 KB | 1 | |
00:13, 18 December 2014 | Summary SME3 ya.JPG (file) | 38 KB | 1 | ||
00:12, 18 December 2014 | MOL SME3 ya.mol2 (file) | ![]() |
811 bytes | 1 | |
19:51, 17 December 2014 | GABR3 FREQ YA.LOG (file) | ![]() |
31 KB | 1 | |
19:48, 17 December 2014 | GABR3 OPT YA.LOG (file) | ![]() |
56 KB | 1 | |
19:43, 17 December 2014 | GaBr3 OPT ya mol.mol2 (file) | ![]() |
350 bytes | 1 | |
19:42, 17 December 2014 | GaBr3 OPT summary ya.JPG (file) | 38 KB | 1 | ||
19:39, 17 December 2014 | GaBr3 IR(631g).JPG (file) | 45 KB | 1 | ||
13:51, 17 December 2014 | SME3 NBO ya NOS.JPG (file) | 21 KB | 1 | ||
13:51, 17 December 2014 | SME3 NBO ya TABLECHARGE.JPG (file) | 30 KB | 1 | ||
13:50, 17 December 2014 | PME4 NBO CHARGENos ya.JPG (file) | 31 KB | 1 | ||
13:48, 17 December 2014 | PME4 NBO CHARGEDist ya.JPG (file) | 30 KB | 1 | ||
13:47, 17 December 2014 | Charge number dsitrib NME4 ya.JPG (file) | 23 KB | 2 | ||
13:46, 17 December 2014 | Charge dsitrib table NME4 ya.JPG (file) | 30 KB | 3 | ||
19:58, 15 December 2014 | BH3 opt1 summary ya.JPG (file) | 42 KB | 4 | ||
19:43, 15 December 2014 | IR PME4 ya.JPG (file) | 47 KB | 1 | ||
19:25, 15 December 2014 | Summary FREQ PME4 ya.JPG (file) | 38 KB | 1 | ||
19:08, 15 December 2014 | Summary OPT ya PME4.JPG (file) | 41 KB | 1 |