Main public logs

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16:47, 25 October 2013 Pp1711 talk contribs uploaded File:Opt and freq of 76 again.mol
16:02, 25 October 2013 Pp1711 talk contribs uploaded File:Irc number51.mol
15:47, 25 October 2013 Pp1711 talk contribs uploaded File:Orientated HOMO.gif
15:46, 25 October 2013 Pp1711 talk contribs uploaded File:LUMO transition state.gif
15:45, 25 October 2013 Pp1711 talk contribs uploaded File:LUMO transition state transparent.gif
15:45, 25 October 2013 Pp1711 talk contribs uploaded File:HOMO transition state transparant.gif
15:45, 25 October 2013 Pp1711 talk contribs uploaded File:HOMO of transition state.gif
14:46, 25 October 2013 Pp1711 talk contribs uploaded File:IRCrun minimsed.mol
14:33, 25 October 2013 Pp1711 talk contribs uploaded File:IRC run number76.mol
14:32, 25 October 2013 Pp1711 talk contribs uploaded File:IRC run number1.mol
14:30, 25 October 2013 Pp1711 talk contribs uploaded File:IRC of unfrozen transition state.svg
14:06, 25 October 2013 Pp1711 talk contribs uploaded File:Unfrozen first positive vibration.gif
14:01, 25 October 2013 Pp1711 talk contribs uploaded File:Unfrozen vibration.gif
13:25, 25 October 2013 Pp1711 talk contribs uploaded File:Unfrozen co-ord run of log.mol
13:12, 25 October 2013 Pp1711 talk contribs uploaded File:Frozen co-ord run of log.mol
13:10, 25 October 2013 Pp1711 talk contribs uploaded File:Frozen co-ord run.mol
12:50, 25 October 2013 Pp1711 talk contribs uploaded File:Guess transition stateopt+freq.mol
12:49, 25 October 2013 Pp1711 talk contribs uploaded File:Animation of transition state opt+freq.gif
12:12, 25 October 2013 Pp1711 talk contribs uploaded File:Animation of transition state otp+freq.gif
11:41, 25 October 2013 Pp1711 talk contribs uploaded File:Guess transition state opt.mol
11:40, 25 October 2013 Pp1711 talk contribs uploaded File:Guess transition state.mol
10:45, 25 October 2013 Pp1711 talk contribs uploaded File:Cis butadiene part a symmetrized.mol
10:45, 25 October 2013 Pp1711 talk contribs uploaded File:LUMO cis butadiene.svg
10:45, 25 October 2013 Pp1711 talk contribs uploaded File:HOMO cis butadiene.svg
10:45, 25 October 2013 Pp1711 talk contribs uploaded File:LUMO cis butadiene MO.gif
10:44, 25 October 2013 Pp1711 talk contribs uploaded File:HOMO cis butadiene MO.gif
10:23, 25 October 2013 Pp1711 talk contribs uploaded File:Cis butadiene part a.mol
16:20, 24 October 2013 Pp1711 talk contribs uploaded File:Boat opt higher theory.mol
15:41, 24 October 2013 Pp1711 talk contribs uploaded File:Opt boat higher.mol
15:25, 24 October 2013 Pp1711 talk contribs uploaded File:Reopt higher chair correct.mol
15:01, 24 October 2013 Pp1711 talk contribs uploaded File:Opt of boat attempt1 berny.mol
14:25, 24 October 2013 Pp1711 talk contribs uploaded File:Reopt higher chair.mol
14:01, 24 October 2013 Pp1711 talk contribs uploaded File:Irc optimised.mol
13:52, 24 October 2013 Pp1711 talk contribs uploaded File:Irc 44.mol
13:50, 24 October 2013 Pp1711 talk contribs uploaded File:Irc path.svg
12:53, 24 October 2013 Pp1711 talk contribs uploaded a new version of File:IR.svg
12:39, 24 October 2013 Pp1711 talk contribs uploaded File:IR for opt chair.svg
12:38, 24 October 2013 Pp1711 talk contribs uploaded File:Transition state b optimisedchair.mol
12:37, 24 October 2013 Pp1711 talk contribs uploaded File:Movie for Ir of optimiseb chair.gif
11:39, 24 October 2013 Pp1711 talk contribs uploaded File:Transitiostatepartb thursday opt.mol
11:07, 24 October 2013 Pp1711 talk contribs uploaded File:IRC graph 1.svg
11:06, 24 October 2013 Pp1711 talk contribs uploaded File:Transitiostatepartb thursday image51.mol
11:06, 24 October 2013 Pp1711 talk contribs uploaded File:Transitiostatepartb thursday image1.mol
19:45, 22 October 2013 Pp1711 talk contribs uploaded File:PartfI.mol
19:40, 22 October 2013 Pp1711 talk contribs uploaded File:Part f i.mol
19:16, 22 October 2013 Pp1711 talk contribs uploaded File:Partf 19.mol
19:15, 22 October 2013 Pp1711 talk contribs uploaded File:Partf 1.mol
19:15, 22 October 2013 Pp1711 talk contribs uploaded File:Partf 20.mol
19:06, 22 October 2013 Pp1711 talk contribs uploaded File:Transitiostatepartf furthermin iii 1.mol
17:33, 22 October 2013 Pp1711 talk contribs uploaded File:Part e part2 chkfile.mol