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Uploads by Ck3112

This special page shows all uploaded files.

File list
Date Name Thumbnail Size Description Versions
11:43, 27 February 2015 Endoexoyo.jpg (file) 171 KB Endo and exo guess transition structures 1
10:09, 27 February 2015 QST2yo.jpg (file) 108 KB QST2 1
10:08, 27 February 2015 Anti2yoyoDTF.png (file) 143 KB anti2 DTF 1
10:08, 27 February 2015 Anti2yoyo.jpg (file) 70 KB anti2 1
10:04, 27 February 2015 React c.png (file) 335 KB Gauche 3 1
09:59, 27 February 2015 Maleic anhydride Cyclohexa-1,3-diene.jpg (file) 156 KB Maleic anhydride (left) and cyclohexa-1,3-diene (right) 1
09:56, 27 February 2015 TS ii LUMO.jpg (file) 246 KB TS LUMO 1
09:56, 27 February 2015 Guess ts ii HOMO.jpg (file) 240 KB TS HOMO 1
09:55, 27 February 2015 TS ii.jpg (file) 105 KB Transition state of ethylene and butadiene 1
09:52, 27 February 2015 Guess ts bii.jpg (file) 97 KB Guess of bicyclo system transition state 1
09:47, 27 February 2015 Cisbutadiene.kitts.jpg (file) 233 KB LUMO of cisbutadiene. 1
09:42, 27 February 2015 Cisbutadiene HOMO.jpg (file) 230 KB HOMO of cisbutadiene 3
09:41, 27 February 2015 Cisbutadiene.jpg (file) 233 KB LUMO of cisbutadiene 3
09:27, 27 February 2015 Part b syn.jpg (file) 93 KB   1
17:29, 26 February 2015 2nd QST2 thu.mol (file) 2 KB   1
15:46, 26 February 2015 Chair b thu.gjf (file) 1 KB   1
15:43, 26 February 2015 Chair b thu3.mol (file) 2 KB Chair, optimised to a TS 1
15:18, 26 February 2015 Chair opt d thu3.mol (file) 2 KB Chair, optimised with frozen coordinate method 1
13:56, 26 February 2015 Allylfragment thu.mol (file) 820 bytes allyl fragment, energy -115.82304010 Hartree, C2v point group 1