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User contributions for Mc608

Results for Mc608 talk block log uploads logs

A user with 735 edits. Account created on 22 February 2011.

14:0614:06, 23 March 2011 diff hist +98 Rep:Mod 3: CouchMA →Intrinisic Reaction Coordinate
14:0314:03, 23 March 2011 diff hist +1,982 Rep:Mod 3: CouchMA →Boat Transition State
14:0214:02, 23 March 2011 diff hist 0 N File:MC IRC Gradient Forceall Scan.jpg No edit summary current
14:0114:01, 23 March 2011 diff hist 0 N File:MC IRC Energy Forceall Scan.jpg No edit summary current
13:5913:59, 23 March 2011 diff hist 0 N File:MC CHAIR TS HF IRC.LOG No edit summary current
13:5713:57, 23 March 2011 diff hist 0 N File:MC IRC Gradient.jpg No edit summary current
13:5613:56, 23 March 2011 diff hist 0 N File:MC IRC Energy.jpg No edit summary current
13:0913:09, 23 March 2011 diff hist +672 Rep:Mod 3: CouchMA →QST2 Optimisation
12:5512:55, 23 March 2011 diff hist +416 Rep:Mod 3: CouchMA →QST2 Optimisation
12:4712:47, 23 March 2011 diff hist +310 Rep:Mod 3: CouchMA →QST2 Optimisation
12:4612:46, 23 March 2011 diff hist 0 N File:MC BOAT TS QST2 FREQ.LOG No edit summary current
12:4312:43, 23 March 2011 diff hist +6 Rep:Mod 3: CouchMA →TS (Berny) Method<REF>[https://wiki.ch.ic.ac.uk/wiki/images/8/8f/MC_CHAIR_TS_HF.LOG TS(Berny) Opt+Freq Log File]</REF>
12:4212:42, 23 March 2011 diff hist +114 Rep:Mod 3: CouchMA →QST2 Optimisation
12:4012:40, 23 March 2011 diff hist +60 Rep:Mod 3: CouchMA →QST2 Optimisation
12:3812:38, 23 March 2011 diff hist +53 Rep:Mod 3: CouchMA →QST2 Optimisation
12:3712:37, 23 March 2011 diff hist +1,107 Rep:Mod 3: CouchMA →Boat Transition State
12:3112:31, 23 March 2011 diff hist 0 N File:MC Boat TS QST2 1.mol No edit summary current
12:2912:29, 23 March 2011 diff hist 0 N File:MC BOAT TS QST2 1.LOG No edit summary current
12:2412:24, 23 March 2011 diff hist +79 Rep:Mod 3: CouchMA →Frozen Coordinate Method
12:2312:23, 23 March 2011 diff hist +63 Rep:Mod 3: CouchMA →Frozen Coordinate Method
12:2012:20, 23 March 2011 diff hist +60 Rep:Mod 3: CouchMA →Frozen Coordinate Method
12:1912:19, 23 March 2011 diff hist 0 Rep:Mod 3: CouchMA →Frozen Coordinate Method
12:1912:19, 23 March 2011 diff hist +1,055 Rep:Mod 3: CouchMA →Chair Transition State
12:1812:18, 23 March 2011 diff hist 0 N File:MC Chair TS Frozen 2.mol No edit summary current
12:1512:15, 23 March 2011 diff hist 0 N File:MC CHAIR TS FROZEN 2.LOG No edit summary current
12:1312:13, 23 March 2011 diff hist 0 N File:MC CHAIR TS FROZEN.LOG No edit summary current
12:1212:12, 23 March 2011 diff hist 0 N File:MC Chair TS Frozen.mol No edit summary current
11:3911:39, 23 March 2011 diff hist +132 Rep:Mod 3: CouchMA →TS (Berny) Method<REF>[https://wiki.ch.ic.ac.uk/wiki/images/8/8f/MC_CHAIR_TS_HF.LOG TS(Berny) Opt+Freq Log File]</REF>
11:3511:35, 23 March 2011 diff hist +417 Rep:Mod 3: CouchMA →Chair Transition State
11:3011:30, 23 March 2011 diff hist +7 Rep:Mod 3: CouchMA →TS (Berny) Method<REF>[https://wiki.ch.ic.ac.uk/wiki/images/8/8f/MC_CHAIR_TS_HF.LOG TS(Berny) Opt+Freq Log File]</REF>
11:2911:29, 23 March 2011 diff hist −63 Rep:Mod 3: CouchMA →TS (Berny) Method<REF>[https://wiki.ch.ic.ac.uk/wiki/images/8/8f/MC_CHAIR_TS_HF.LOG TS(Berny) Opt+Freq Log File]</REF>
11:2711:27, 23 March 2011 diff hist 0 N File:MC CHAIR TS FREQ.LOG No edit summary current
11:2211:22, 23 March 2011 diff hist +953 Rep:Mod 3: CouchMA →Chair Transition State
11:1311:13, 23 March 2011 diff hist 0 N File:MC CHAIR TS HF.LOG No edit summary current
10:5010:50, 23 March 2011 diff hist +150 Rep:Mod 3: CouchMA →Transition state analysis
10:4510:45, 23 March 2011 diff hist 0 N File:MC Allyl Fragment.mol No edit summary current
10:4310:43, 23 March 2011 diff hist +524 Rep:Mod 3: CouchMA →Transition state analysis
10:4310:43, 23 March 2011 diff hist 0 N File:MC ALLYL FRAGMENT OPT.LOG No edit summary current
10:0910:09, 23 March 2011 diff hist +61 Rep:Mod 3: CouchMA →Boat Transition State
10:0910:09, 23 March 2011 diff hist +61 Rep:Mod 3: CouchMA →Chair Transition State

18:0318:03, 22 March 2011 diff hist +424 Rep:Mod 3: CouchMA →Transition state analysis
18:0318:03, 22 March 2011 diff hist 0 N File:MC Boat TS Opt.mol No edit summary current
18:0018:00, 22 March 2011 diff hist 0 N File:MC Chair TS Opt.mol No edit summary current
17:5317:53, 22 March 2011 diff hist 0 N File:MC Boat TS.gif No edit summary current
17:5217:52, 22 March 2011 diff hist 0 N File:MC Chair TS.gif No edit summary current
17:4817:48, 22 March 2011 diff hist +14 Rep:Mod 3: CouchMA →Optimisation of conformers
17:4717:47, 22 March 2011 diff hist +433 Rep:Mod 3: CouchMA →Cope Rearrangement of 1,5-hexadiene
17:4317:43, 22 March 2011 diff hist 0 N File:MC Anti2 Opt DFT.mol No edit summary current
17:3517:35, 22 March 2011 diff hist +2 Rep:Mod 3: CouchMA →Vibrational Analysis of the Anti 2 Conformation<ref> Anti 2 Freq Repository {{DOI|10042/to-8045}}</ref>
17:3217:32, 22 March 2011 diff hist +73 Rep:Mod 3: CouchMA →Vibrational Analysis of the Anti 2 Conformation<ref> Anti 2 Freq Repository {{DOI|10042/to-8045}}</ref>

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