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Uploads by Yc8512

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Date Name Thumbnail Size Description Versions
13:45, 28 January 2016 Ariel TS AM1.gif (file) 1.17 MB   1
12:55, 28 January 2016 TS AM1 optimization.mol (file) 2 KB   1
10:02, 28 January 2016 Image 16.png (file) 18 KB   1
09:33, 28 January 2016 Ethylene HOMO-LUMO.PNG (file) 56 KB   1
09:04, 28 January 2016 Image 15.PNG (file) 107 KB   1
09:03, 28 January 2016 Image 14.PNG (file) 107 KB   2
08:28, 28 January 2016 Summery 2.PNG (file) 9 KB   1
08:27, 28 January 2016 Summery 1.PNG (file) 20 KB   1
08:24, 28 January 2016 Table 2.PNG (file) 9 KB   3
08:15, 28 January 2016 Boat Reoptimization frequency table.PNG (file) 22 KB   2
08:14, 28 January 2016 BOAT REOPTIMIZATION.LOG (file) 438 KB   2
08:14, 28 January 2016 Boat Reoptimization.gif (file) 1.07 MB   2
08:12, 28 January 2016 Boat Reoptimization.mol (file) 2 KB   3
07:57, 28 January 2016 Chair reoptimize.gif (file) 621 KB   3
07:54, 28 January 2016 Chair reoptimize frequency table.PNG (file) 21 KB   2
07:54, 28 January 2016 CHAIR REOPTIMIZE.LOG (file) 216 KB   2
07:50, 28 January 2016 CHAIR REOPTIMIZE.mol (file) 2 KB   2
23:27, 27 January 2016 CIS BUTADIENE OPTIMIZATION.LOG (file) 84 KB   2
23:22, 27 January 2016 Cis butadiene optimization.mol (file) 1,008 bytes   1
22:54, 27 January 2016 Ariel Image 13.png (file) 4 KB   1
20:17, 27 January 2016 Ariel Image 12.png (file) 7 KB   1
18:41, 27 January 2016 Ariel Image 11.png (file) 7 KB   1
17:34, 27 January 2016 Boat IRC 150 RMS Gradient and Energy.PNG (file) 35 KB   1
17:31, 27 January 2016 Boat IRC 150 Frequency table.PNG (file) 25 KB   1
17:30, 27 January 2016 BOAT IRC 150.LOG (file) 472 KB   1
16:43, 27 January 2016 Energy and RMS Gradient of 150.PNG (file) 31 KB   1
16:35, 27 January 2016 QST2 anti2 (1).mol (file) 2 KB   2
16:20, 27 January 2016 Ariel Image 10.png (file) 4 KB   1
16:19, 27 January 2016 QS2(2) Screen shot.PNG (file) 59 KB   1
15:34, 27 January 2016 QST2 anti2 screeshot.PNG (file) 41 KB   1
15:04, 27 January 2016 F IRC minimum last point.gif (file) 487 KB   1
15:03, 27 January 2016 F IRC minimum last poinT frequency table.PNG (file) 42 KB   1
15:02, 27 January 2016 F IRC MINIMUM LAST POINT.LOG (file) 209 KB   1
14:56, 27 January 2016 F IRC minimum last point.mol (file) 2 KB   1
14:44, 27 January 2016 F IRC graph.PNG (file) 34 KB   1
14:14, 27 January 2016 F IRC Frequency table.PNG (file) 36 KB   1
14:12, 27 January 2016 F IRC.LOG (file) 635 KB   1
13:29, 27 January 2016 QST anti2(2) frequency table.PNG (file) 42 KB   1
13:28, 27 January 2016 QST2 ANTI2 (2).LOG (file) 592 KB   1
13:27, 27 January 2016 QST2 anti2(2).gif (file) 866 KB   1
13:20, 27 January 2016 QST2 anti2 (2).mol (file) 2 KB   1
13:15, 27 January 2016 CHAIR TS (2).mol (file) 2 KB   1
13:01, 27 January 2016 Chair TS(2) frequency IR SPECTRUM.PNG (file) 11 KB   1
13:01, 27 January 2016 Chair TS(2) frequency table.PNG (file) 40 KB   1
12:58, 27 January 2016 CHAIR TS (2).LOG (file) 251 KB   1
12:57, 27 January 2016 Chair ts (2).gif (file) 849 KB   1
12:32, 27 January 2016 Chair berny IR spetrum.PNG (file) 11 KB   1
12:31, 27 January 2016 Chairs berny frequency table.PNG (file) 35 KB   1
12:27, 27 January 2016 B OPTIMIZATION.LOG (file) 238 KB   1
12:15, 27 January 2016 B.gif (file) 796 KB   1
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