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User contributions for Sds111

Results for Sds111 talk block log uploads logs

A user with 988 edits. Account created on 20 January 2014.

13:2513:25, 11 March 2014 diff hist −6 Rep:Mod:CHEM121500122000 →An allyl (CH2CHCH2) fragment was optimised at the HF/3-21G level of theory.
13:2513:25, 11 March 2014 diff hist 0 N File:Ts chair guess imagvibat818.gif No edit summary current
13:2513:25, 11 March 2014 diff hist 0 N File:124225optimisedallylfragment.png No edit summary current
13:2413:24, 11 March 2014 diff hist +389 Rep:Mod:CHEM121500122000 →IR Data

15:4915:49, 10 March 2014 diff hist +405 Rep:Mod:CHEM121500122000 →IR Data
15:2015:20, 10 March 2014 diff hist −2 Rep:Mod:CHEM121500122000 →Comparison between the HF/3-21G and B3LYP/6-31G* levels of theory.
15:2015:20, 10 March 2014 diff hist 0 N File:1718 32.gif No edit summary current
15:2015:20, 10 March 2014 diff hist 0 N File:1537 29.gif No edit summary current
15:1915:19, 10 March 2014 diff hist +199 Rep:Mod:CHEM121500122000 →IR Data
15:1715:17, 10 March 2014 diff hist +19 Rep:Mod:CHEM121500122000 →IR Data
15:1615:16, 10 March 2014 diff hist +42 Rep:Mod:CHEM121500122000 →IR Data
15:1515:15, 10 March 2014 diff hist +60 Rep:Mod:CHEM121500122000 →The Anti2 conformation.
15:1415:14, 10 March 2014 diff hist 0 N File:124225IRspectrumanti2.svg No edit summary current
15:1315:13, 10 March 2014 diff hist −8 Rep:Mod:CHEM121500122000 →Optimizing energies of 1,5-hexadiene
15:1315:13, 10 March 2014 diff hist +38 Rep:Mod:CHEM121500122000 →Comparison between the HF/3-21G and B3LYP/6-31G* levels of theory.
15:1315:13, 10 March 2014 diff hist −35 Rep:Mod:CHEM121500122000 →The Anti2 conformation.
15:1215:12, 10 March 2014 diff hist +39 Rep:Mod:CHEM121500122000 →Optimizing energies of 1,5-hexadiene
15:1215:12, 10 March 2014 diff hist −14 Rep:Mod:CHEM121500122000 →Comparison between the HF/3-21G and B3LYP/6-31G* levels of theory for the anti2 conformation.
14:5314:53, 10 March 2014 diff hist +71 Rep:Mod:CHEM121500122000 →Comparison between the HF/3-21G and B3LYP/6-31G* levels of theory for the anti2 conformation.
14:5314:53, 10 March 2014 diff hist +139 Rep:Mod:CHEM121500122000 →Comparison between the HF/3-21G and B3LYP/6-31G* levels of theory for the anti2 conformation.
14:5214:52, 10 March 2014 diff hist 0 N File:124225anti2view2.png No edit summary current
14:5214:52, 10 March 2014 diff hist 0 N File:124225anti2b3lypview2.png No edit summary current
14:4814:48, 10 March 2014 diff hist −1 Rep:Mod:CHEM121500122000 →Optimizing energies of 1,5-hexadiene
14:4814:48, 10 March 2014 diff hist −14 Rep:Mod:CHEM121500122000 →Comparison between the HF/3-21G and B3LYP/6-31G* levels of theory for the anti2 conformation.
14:4714:47, 10 March 2014 diff hist +82 Rep:Mod:CHEM121500122000 →Comparison between the HF/3-21G and B3LYP/6-31G* levels of theory for the anti2 conformation.
14:4714:47, 10 March 2014 diff hist +37 Rep:Mod:CHEM121500122000 →Comparison between the HF/3-21G and B3LYP/6-31G* levels of theory for the anti2 conformation.
14:4614:46, 10 March 2014 diff hist 0 N File:124225anti2b3lyp.png No edit summary current
14:4414:44, 10 March 2014 diff hist +18 Rep:Mod:CHEM121500122000 →Comparison between the HF/3-21G and B3LYP/6-31G* levels of theory for the anti2 conformation.
14:4114:41, 10 March 2014 diff hist +218 Rep:Mod:CHEM121500122000 →Optimizing energies of 1,5-hexadiene
14:4114:41, 10 March 2014 diff hist 0 N File:Anti2B3LYP .LOG No edit summary
14:2714:27, 10 March 2014 diff hist +4 Rep:Mod:CHEM121500122000 →Comparison between the HF/3-21G and B3LYP/6-31G* levels of theory for the anti2 conformation.
14:2714:27, 10 March 2014 diff hist +103 Rep:Mod:CHEM121500122000 →Optimizing energies of 1,5-hexadiene
14:2014:20, 10 March 2014 diff hist 0 N File:Anti2 .LOG No edit summary current
14:2014:20, 10 March 2014 diff hist 0 N File:124225anti2.png No edit summary current
14:1914:19, 10 March 2014 diff hist +95 Rep:Mod:CHEM121500122000 →Optimizing energies of 1,5-hexadiene
14:0114:01, 10 March 2014 diff hist +121 Rep:Mod:CHEM121500122000 →Optimizing energies of 1,5-hexadiene
14:0114:01, 10 March 2014 diff hist 0 N File:124225guache3.png No edit summary current
14:0114:01, 10 March 2014 diff hist 0 N File:Guache3 .LOG No edit summary current
13:4513:45, 10 March 2014 diff hist +179 Rep:Mod:CHEM121500122000 →Optimizing energies of 1,5-hexadiene
13:3213:32, 10 March 2014 diff hist +112 Rep:Mod:CHEM121500122000 →Optimizing energies of 1,5-hexadiene
13:3213:32, 10 March 2014 diff hist 0 N File:Guache2 .LOG No edit summary current
13:3113:31, 10 March 2014 diff hist 0 N File:124225guache2.png No edit summary current
13:3113:31, 10 March 2014 diff hist +2 Rep:Mod:CHEM121500122000 →Optimizing energies of 1,5-hexadiene
13:2013:20, 10 March 2014 diff hist 0 N File:Anti4 .LOG No edit summary current
13:1713:17, 10 March 2014 diff hist +2 Rep:Mod:CHEM121500122000 →Optimizing energies of 1,5-hexadiene
13:1713:17, 10 March 2014 diff hist 0 N File:Anti1 ss.LOG No edit summary current
13:1513:15, 10 March 2014 diff hist +493 Rep:Mod:CHEM121500122000 →Yr 3 Physical Computational Module
13:1413:14, 10 March 2014 diff hist 0 N File:124225anti1.LOG No edit summary current
13:1213:12, 10 March 2014 diff hist 0 N File:124225anti1.png No edit summary current
12:5312:53, 10 March 2014 diff hist +36 N Rep:Mod:CHEM121500122000 Created page with "=Yr 3 Physical Computational Module="

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