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This special page shows all uploaded files.
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Date
Name
Thumbnail
Size
Description
Versions
12:16, 21 March 2014
Cyclo 2 EXO HOMO ylc.png
(
file
)
32 KB
3
12:12, 21 March 2014
Cyclo 2 ENDO HOMO ylc.png
(
file
)
34 KB
2
22:41, 20 March 2014
Cyclo 2 EXO LUMO ylc.png
(
file
)
26 KB
1
22:41, 20 March 2014
Cyclo 2 ENDO LUMO ylc.png
(
file
)
26 KB
1
22:41, 20 March 2014
Cyclo 1 LUMO ylc.png
(
file
)
15 KB
1
22:41, 20 March 2014
Cyclo 1 HOMO ylc.png
(
file
)
15 KB
1
16:43, 20 March 2014
Endo am1 ts ylc.PNG
(
file
)
107 KB
2
16:42, 20 March 2014
Endo DFT ts ylc.PNG
(
file
)
131 KB
2
16:41, 20 March 2014
Exo DFT ts 1 ylc.PNG
(
file
)
113 KB
1
16:41, 20 March 2014
Exo am1 ts 1 ylc.PNG
(
file
)
112 KB
1
16:41, 20 March 2014
Exo am1 LUMO 35 ylc.PNG
(
file
)
582 KB
1
16:41, 20 March 2014
Exo am1 HOMO 34 ylc.PNG
(
file
)
563 KB
1
16:41, 20 March 2014
Endo am1 LUMO 35 ylc.PNG
(
file
)
544 KB
1
16:41, 20 March 2014
Endo am1 HOMO 34 ylc.PNG
(
file
)
551 KB
1
16:41, 20 March 2014
CYCLO2 TS OPTIMSED EXO DFT YLC.LOG
(
file
)
369 KB
1
16:41, 20 March 2014
CYCLO2 TS OPTIMSED EXO AM1 YLC.LOG
(
file
)
1.29 MB
1
17:35, 19 March 2014
Endo am1 ts vibrational mode ylc.gif
(
file
)
703 KB
1
17:35, 19 March 2014
Endo am1 ts IR ylc.PNG
(
file
)
41 KB
1
17:35, 19 March 2014
CYCLO2 TS OPTIMSED ENDO DFT.LOG
(
file
)
385 KB
1
17:16, 19 March 2014
CYCLO2 TS OPTIMSED ENDO BEFORE ylc.LOG
(
file
)
1.36 MB
1
22:29, 18 March 2014
Cyclo 1 ts optimised am1 guess ylc vibration lowest 14709mode.gif
(
file
)
447 KB
1
22:28, 18 March 2014
CYCLO 1 TS OPTIMISED DFT GUESS YLC.LOG
(
file
)
228 KB
1
22:28, 18 March 2014
CYCLO 1 TS OPTIMISED AM1 GUESS YLC.LOG
(
file
)
595 KB
1
16:12, 18 March 2014
IR spectrum of anti 2.PNG
(
file
)
47 KB
1
16:12, 18 March 2014
IR spectrum of anti 1.PNG
(
file
)
47 KB
1
14:42, 18 March 2014
Cyclo 1 ts optimised DFT guess ylc structure.PNG
(
file
)
129 KB
1
14:29, 18 March 2014
Cyclo 1 ts optimised am1 guess ylc structure.png
(
file
)
536 KB
1
14:29, 18 March 2014
Cyclo 1 ts optimised am1 guess ylc LUMO 18.png
(
file
)
3.63 MB
1
14:29, 18 March 2014
Cyclo 1 ts optimised am1 guess ylc HOMO 17.png
(
file
)
4.12 MB
1
14:28, 18 March 2014
Cis butadiene optimised DFT ylc.mol
(
file
)
1,008 bytes
1
14:27, 18 March 2014
Cis butadiene optimised am1 ylc.mol
(
file
)
1,008 bytes
1
14:07, 18 March 2014
Cis butadiene optimised DFT ylc LUMO 16.png
(
file
)
3.45 MB
1
14:07, 18 March 2014
Cis butadiene optimised DFT ylc HOMO 15.png
(
file
)
3.06 MB
1
14:06, 18 March 2014
Cis butadiene optimised am1 ylc LUMO 12.png
(
file
)
3.31 MB
1
14:06, 18 March 2014
Cis butadiene optimised am1 ylc HOMO 11.png
(
file
)
3.36 MB
1
22:34, 17 March 2014
Cyclo 1 ts optimised am1 guess ylc IR.png
(
file
)
3.28 MB
1
22:07, 17 March 2014
CIS BUTADIENE OPTIMISED DFT YLC.LOG
(
file
)
209 KB
1
22:07, 17 March 2014
CIS BUTADIENE OPTIMISED AM1 YLC.LOG
(
file
)
29 KB
1
22:07, 17 March 2014
CIS BUTADIENE FREQ AM1 YLC.LOG
(
file
)
43 KB
1
22:07, 17 March 2014
Cycloaddition with malonic.png
(
file
)
15 KB
1
22:07, 17 March 2014
CIS BUTADIENE FREQ DFT YLC.LOG
(
file
)
46 KB
1
22:07, 17 March 2014
Cycloaddition with ethene.png
(
file
)
7 KB
1
22:07, 17 March 2014
Cyclo 1 ts optimised am1 guess ylc vibration mode.gif
(
file
)
427 KB
1
17:39, 17 March 2014
IR spectrum of gauche 4.PNG
(
file
)
51 KB
1
17:39, 17 March 2014
IR spectrum of gauche 3.PNG
(
file
)
47 KB
3
17:24, 17 March 2014
Chair ts guess optimised ylc - ISC - opt.mol
(
file
)
2 KB
1
17:23, 17 March 2014
CHAIR TS GUESS OPTIMISED YLC - ISC.mol
(
file
)
2 KB
2
17:18, 17 March 2014
ICR path.png
(
file
)
15 KB
1
16:43, 17 March 2014
CHAIR TS GUESS OPTIMISED YLC - ISC.LOG
(
file
)
465 KB
1
16:43, 17 March 2014
CHAIR TS GUESS OPTIMISED YLC - ISC - opt.LOG
(
file
)
135 KB
1
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