User contributions for Bnguyen

07:2307:23, 28 October 2011 diff hist +38 Rep:Mod:bnguyen →Analysis
07:2207:22, 28 October 2011 diff hist −33 Rep:Mod:bnguyen →Vibrational frequencies
07:2207:22, 28 October 2011 diff hist +43 Rep:Mod:bnguyen →Bond lengths

20:0720:07, 27 October 2011 diff hist +250 Rep:Mod:bnguyen →Data presentation
20:0320:03, 27 October 2011 diff hist +5 Rep:Mod:bnguyen →Data presentation
19:5819:58, 27 October 2011 diff hist +32 Rep:Mod:bnguyen →Starting point
19:5719:57, 27 October 2011 diff hist −25 Rep:Mod:bnguyen No edit summary
19:5619:56, 27 October 2011 diff hist +33 Rep:Mod:bnguyen →Methods of calculation
19:5519:55, 27 October 2011 diff hist −32 Rep:Mod:bnguyen →Ab initio calculations
19:5519:55, 27 October 2011 diff hist +433 Rep:Mod:bnguyen →Analysis
19:5319:53, 27 October 2011 diff hist −410 Rep:Mod:bnguyen →Energies
19:5319:53, 27 October 2011 diff hist −4 Rep:Mod:bnguyen →Analysis
19:5319:53, 27 October 2011 diff hist +32 Rep:Mod:bnguyen →Analysis
19:5019:50, 27 October 2011 diff hist +914 Rep:Mod:bnguyen →Bond lengths
19:2119:21, 27 October 2011 diff hist +32 Rep:Mod:bnguyen →Molecular orbitals
19:2019:20, 27 October 2011 diff hist +458 Rep:Mod:bnguyen →Molecular orbitals
19:1419:14, 27 October 2011 diff hist +410 Rep:Mod:bnguyen →Bond lengths
19:1419:14, 27 October 2011 diff hist −410 Rep:Mod:bnguyen →Energies
19:1019:10, 27 October 2011 diff hist +30 Rep:Mod:bnguyen →Molecular orbitals
19:0919:09, 27 October 2011 diff hist +124 Rep:Mod:bnguyen →Analysis
19:0719:07, 27 October 2011 diff hist +2 Rep:Mod:bnguyen →Energies
19:0719:07, 27 October 2011 diff hist +2 Rep:Mod:bnguyen →Analysis
19:0719:07, 27 October 2011 diff hist +392 Rep:Mod:bnguyen →Energies
18:5818:58, 27 October 2011 diff hist +506 Rep:Mod:bnguyen →Analysis
18:4818:48, 27 October 2011 diff hist +522 Rep:Mod:bnguyen No edit summary
18:4018:40, 27 October 2011 diff hist 0 File:Dont panic.jpg uploaded a new version of "File:Dont panic.jpg" current
18:3618:36, 27 October 2011 diff hist 0 N File:Dont panic.jpg No edit summary
18:3618:36, 27 October 2011 diff hist 0 N File:A beginners guide.jpg No edit summary current
18:3418:34, 27 October 2011 diff hist −2,567 Rep:Mod:bnguyen Replaced content with "A beginner's guide"

20:1720:17, 26 October 2011 diff hist +1,958 Talk:Mod:MJW11 No edit summary current
20:0520:05, 26 October 2011 diff hist −79 Talk:Mod:thatssoraven No edit summary current
20:0020:00, 26 October 2011 diff hist +2,425 N Talk:Mod:BYL109 Created page with "===Q1=== *Your energies for 3 and 4 are slightly off. I think it’s because you used hydrogenated product of 1 rather than 2, judging from the pictures you included. *You corr..." current
19:5319:53, 26 October 2011 diff hist +3,193 N User talk:Ds2909 Created page with "===Q1=== *Correct energies for 1 and 2. Reasonable explanation of the endo rule and the torsional strain, although you could have been a little bit more specific as to which par..." current
19:4719:47, 26 October 2011 diff hist +2,649 N Talk:Mod:ht309mod1 Created page with "===Q1=== *Correct energies for 1, 2, 3 and 4. *kcal.mol-1 and kJ.mol-1 *Diels-Alder cycloadditions are not all under kinetic control. If you see the conditions being >200 C, ..." current
19:2919:29, 26 October 2011 diff hist +3,103 N Talk:Mod:ms mod1 Created page with "===Q1=== *“hyperconjucation” should be “hyperconjugation” *Correct energies for 1 and 2. You correctly identify the torsion energy as the main contributor to the diffe..." current
19:1819:18, 26 October 2011 diff hist +3,051 N Talk:Mod4:Tcg06 Created page with "===Q1=== *Structure 3 was wrong, hence the wrong energy. *The ChemDraw picture of structure 4 is wrong. *Using compound numbering would have made it much easier to follow your..." current
19:1419:14, 26 October 2011 diff hist +2,881 Talk:Mod:Salvatore89 No edit summary current
19:0719:07, 26 October 2011 diff hist +2,630 N Talk:Mod:thatssoraven Created page with "===Q1=== *"ab inition" should be "ab initio". *Correct energies for 1, 2, 3 and 4. I got 99:1 for exo:endo under equilibrium. Far higher ratio for 3 and 4. You might have mista..."
19:0319:03, 26 October 2011 diff hist +2,366 N Talk:Mod:LS1109 Created page with "===Q1=== *Spot on energies of 1, 2, 3 and 4. *Good and well-detailed analysis on the difference in energy between 1 and 2. *Very good analysis for comparison between 3 and 4. ..." current
18:5518:55, 26 October 2011 diff hist +3,763 N Talk:Mod:fs1309 Created page with "===Q1=== *Where are the calculated data for structure 1 and 2? *"bond angle of a double can no longer" should be ''double bond". *You correctly calculated the energies of 3 an..." current

14:0514:05, 22 October 2011 diff hist −26 Talk:Mod:jlm2012 No edit summary current
14:0414:04, 22 October 2011 diff hist +6,391 N Talk:Mod:jlm2012 Created page with "===Q1=== * It would be much easier for marker if you follow the numbering in the question: '''1''', '''2''', '''3''' and '''4'''. * Your MM2 energies for '''1''' and '''2''' ar..."

12:3812:38, 16 October 2011 diff hist +1 Talk:Mod 1: Celeste van den Bosch →First week feedback
12:3812:38, 16 October 2011 diff hist +1,845 N Talk:Mod 1: Celeste van den Bosch Created page with "===First week feedback=== Overall it's hard to give a good assessment of your work, mainly because there's no indication as to which answer is completed. Consequently, I'm giving..."
12:0512:05, 16 October 2011 diff hist +1 Talk:Mod:Salvatore89 →First week feedback
12:0412:04, 16 October 2011 diff hist +1 Talk:Mod:Salvatore89 →First week feedback
12:0412:04, 16 October 2011 diff hist +1,781 N Talk:Mod:Salvatore89 Created page with "===First week feedback=== Overall I think your answer to question 1 is good and cover all the information required. You also gave a good assessment of the computational results. ..."

12:0912:09, 13 October 2011 diff hist +12 N Rep:Mod:feedback Created page with "Place holder"
09:5409:54, 13 October 2011 diff hist +301 Mod:organic →Troubleshooting
09:4909:49, 13 October 2011 diff hist −83 Mod:organic →Submitting this file to the SCAN for geometry optimization

28 October 2011

27 October 2011

26 October 2011

22 October 2011

16 October 2011

13 October 2011