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18:08, 2 November 2012 Ss8810 talk contribs uploaded File:Boat opt 2.mol
17:26, 2 November 2012 Ss8810 talk contribs uploaded File:CHAIR TS 2.mol
16:59, 2 November 2012 Ss8810 talk contribs uploaded File:Irc chair graph.PNG
16:56, 2 November 2012 Ss8810 talk contribs uploaded File:Irc chair.PNG
16:43, 2 November 2012 Ss8810 talk contribs uploaded File:OPT BOAT QST2.mol
16:38, 2 November 2012 Ss8810 talk contribs uploaded File:CHAIR TS GUESS OPT FROZENCOORDIANTE 2.mol
16:29, 2 November 2012 Ss8810 talk contribs uploaded File:CHAIR TS GUESS OPT+FREQ.mol
16:23, 2 November 2012 Ss8810 talk contribs uploaded File:C3H5 OPT HF 321G.mol
16:07, 2 November 2012 Ss8810 talk contribs uploaded File:15HEXADIENE REACT ANTI CI B3LYP631G.mol
16:02, 2 November 2012 Ss8810 talk contribs uploaded File:15HEXADIENE REACT ANTI CI.mol
15:48, 2 November 2012 Ss8810 talk contribs uploaded File:Anti33.PNG
15:46, 2 November 2012 Ss8810 talk contribs uploaded File:Anti22.PNG
15:30, 2 November 2012 Ss8810 talk contribs uploaded File:15HEXADIENE REACT GAUCHE.mol
15:27, 2 November 2012 Ss8810 talk contribs uploaded File:15HEXADIENE REACT ANTI.mol
14:34, 2 November 2012 Ss8810 talk contribs uploaded File:Exo vib.gif
14:32, 2 November 2012 Ss8810 talk contribs uploaded File:Endo vib.gif
14:28, 2 November 2012 Ss8810 talk contribs uploaded File:Endo HOMO2.PNG
14:25, 2 November 2012 Ss8810 talk contribs uploaded File:Exo HOMO2.PNG
14:13, 2 November 2012 Ss8810 talk contribs uploaded File:Endo bond length.PNG
14:12, 2 November 2012 Ss8810 talk contribs uploaded File:Exobondlength.PNG
13:56, 2 November 2012 Ss8810 talk contribs uploaded File:Endo OPT TS.mol
13:39, 2 November 2012 Ss8810 talk contribs uploaded File:Endo opt am1.mol
13:31, 2 November 2012 Ss8810 talk contribs uploaded File:Exo opt ts.mol
13:22, 2 November 2012 Ss8810 talk contribs uploaded File:Exo opt am1.mol
12:17, 2 November 2012 Ss8810 talk contribs uploaded File:Opt min exo ts.mol
11:10, 2 November 2012 Ss8810 talk contribs uploaded File:OPT MIN EXO.mol
10:19, 2 November 2012 Ss8810 talk contribs uploaded File:Dielsalder ts lowposfreq.gif
10:14, 2 November 2012 Ss8810 talk contribs uploaded File:Dielsalder ts negfreq.gif
10:12, 2 November 2012 Ss8810 talk contribs uploaded File:Dielsalder tsberny optfreq.log
09:58, 2 November 2012 Ss8810 talk contribs uploaded File:Dielsalder ts geom.PNG
09:56, 2 November 2012 Ss8810 talk contribs uploaded File:Dielsalder tsberny optfreq LUMO.PNG
09:55, 2 November 2012 Ss8810 talk contribs uploaded File:Dielsalder tsberny optfreq HOMO.PNG
21:38, 1 November 2012 Ss8810 talk contribs uploaded File:Dielsalder tsberny optfreq.mol
21:23, 1 November 2012 Ss8810 talk contribs uploaded File:Dielsalder ts guess22.PNG
21:23, 1 November 2012 Ss8810 talk contribs uploaded File:Dielsalder ts guess.PNG
17:42, 1 November 2012 Ss8810 talk contribs uploaded File:Lumo cisbutadiene.PNG
17:41, 1 November 2012 Ss8810 talk contribs uploaded File:Homo cisbutadiene.PNG
14:38, 19 October 2012 Ss8810 talk contribs uploaded a new version of File:NH3BH3 optimisation summary.PNG
10:13, 19 October 2012 Ss8810 talk contribs uploaded File:BBR3 opt GEN.LOG
08:38, 19 October 2012 Ss8810 talk contribs uploaded File:BH3 opt.LOG
08:35, 19 October 2012 Ss8810 talk contribs uploaded File:BH3 opt 631G DP.LOG
19:12, 18 October 2012 Ss8810 talk contribs uploaded File:Borazine nbo chargedistribution.PNG
19:11, 18 October 2012 Ss8810 talk contribs uploaded File:Borazine nbo charges.PNG
19:09, 18 October 2012 Ss8810 talk contribs uploaded File:Borazine nbo summary.PNG
19:03, 18 October 2012 Ss8810 talk contribs uploaded File:BORAZINE freq.mol
19:02, 18 October 2012 Ss8810 talk contribs uploaded File:BORAZINE freq summary.PNG
18:49, 18 October 2012 Ss8810 talk contribs uploaded File:BORAZINE 631G OPT.mol
18:48, 18 October 2012 Ss8810 talk contribs uploaded File:Borazine 631g opt.PNG
18:40, 18 October 2012 Ss8810 talk contribs uploaded a new version of File:Borazine 321g opt.mol
18:35, 18 October 2012 Ss8810 talk contribs uploaded a new version of File:Borazine 321g optimisation summary.PNG