User contributions for Sl2810
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4 December 2012
- 14:2514:25, 4 December 2012 diff hist 0 N File:Sl2810ethyleneLUMO.png No edit summary current
- 14:2514:25, 4 December 2012 diff hist +178 Rep:Mod:SSYL Computational Labs - Module 3 →B) cis-Butadiene and Ethylene Transition State
- 14:1914:19, 4 December 2012 diff hist +53 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation: cis-Butadiene
- 14:1814:18, 4 December 2012 diff hist −63 Rep:Mod:SSYL Computational Labs - Module 3 →D) Intrinsic Reaction Coordinate (IRC)
- 14:1614:16, 4 December 2012 diff hist 0 Rep:Mod:SSYL Computational Labs - Module 3 →Comparison of 1,5-Hexadiene Conformations
- 14:1614:16, 4 December 2012 diff hist +5 Rep:Mod:SSYL Computational Labs - Module 3 →Comparison of 1,5-Hexadiene Conformations
- 14:1614:16, 4 December 2012 diff hist 0 Rep:Mod:SSYL Computational Labs - Module 3 →Comparison of 1,5-Hexadiene Conformations
- 14:1514:15, 4 December 2012 diff hist +10 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation of Anti 2 1,5-Hexadiene using a 6-31G(d) Basis Set
- 14:1514:15, 4 December 2012 diff hist +5 Rep:Mod:SSYL Computational Labs - Module 3 →Comparison of 1,5-Hexadiene Conformations
- 14:1514:15, 4 December 2012 diff hist +31 Rep:Mod:SSYL Computational Labs - Module 3 →A) Optimisation using the QST2 Method
- 14:1214:12, 4 December 2012 diff hist +30 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation: cis-Butadiene
- 14:1214:12, 4 December 2012 diff hist +96 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation: cis-Butadiene
- 14:1114:11, 4 December 2012 diff hist 0 N File:OPTIMISATION631Gsl2810.LOG No edit summary current
- 14:1114:11, 4 December 2012 diff hist 0 N File:OPTIMISATION321Gsl2810.LOG No edit summary current
- 14:1014:10, 4 December 2012 diff hist +61 Rep:Mod:SSYL Computational Labs - Module 3 →A) Optimisation using the QST2 Method
- 14:1014:10, 4 December 2012 diff hist 0 N File:OPTIMISATIONQST2AFTERANGLES.LOG No edit summary current
- 14:0914:09, 4 December 2012 diff hist 0 N File:OPTIMISATIONQST2.LOG No edit summary current
- 14:0914:09, 4 December 2012 diff hist +43 Rep:Mod:SSYL Computational Labs - Module 3 →D) Intrinsic Reaction Coordinate (IRC)
- 14:0814:08, 4 December 2012 diff hist 0 N File:Sl2810irc.log No edit summary current
- 14:0814:08, 4 December 2012 diff hist +36 Rep:Mod:SSYL Computational Labs - Module 3 →C) Optimisation of the Terminal Bonds
- 14:0814:08, 4 December 2012 diff hist 0 N File:CHAIRARRANGEMENT OPT FROZENCOOR 2 PARTD.LOG No edit summary current
- 14:0814:08, 4 December 2012 diff hist +28 Rep:Mod:SSYL Computational Labs - Module 3 →B) Optimisation using the Frozen Coordinate Method
- 14:0714:07, 4 December 2012 diff hist 0 N File:CHAIRARRANGEMENT OPT FROZENCOOR.LOG No edit summary current
- 14:0714:07, 4 December 2012 diff hist +22 Rep:Mod:SSYL Computational Labs - Module 3 →A) Optimisation of Transition State
- 14:0714:07, 4 December 2012 diff hist 0 N File:CHAIRARRANGEMENT OPT+FREQ.LOG No edit summary current
- 14:0614:06, 4 December 2012 diff hist +41 Rep:Mod:SSYL Computational Labs - Module 3 →Optimising the "Chair" and "Boat" Configurations
- 14:0614:06, 4 December 2012 diff hist +88 Rep:Mod:SSYL Computational Labs - Module 3 →Optimising the "Chair" and "Boat" Configurations
- 14:0514:05, 4 December 2012 diff hist 0 N File:Sl2810CH2CHCH2 opt.LOG No edit summary current
- 14:0414:04, 4 December 2012 diff hist +13 Rep:Mod:SSYL Computational Labs - Module 3 →Frequency Analysis of Anti 2 1,5-Hexadiene
- 14:0414:04, 4 December 2012 diff hist 0 N File:Sl2810anti2freq.LOG No edit summary current
- 14:0314:03, 4 December 2012 diff hist +12 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation of Anti 2 1,5-Hexadiene using a 6-31G(d) Basis Set
- 14:0314:03, 4 December 2012 diff hist 0 N File:Sl2810anti2631g.LOG No edit summary current
- 14:0314:03, 4 December 2012 diff hist +36 Rep:Mod:SSYL Computational Labs - Module 3 →Comparison of 1,5-Hexadiene Conformations
- 14:0214:02, 4 December 2012 diff hist 0 N File:Sl2810gauche3.LOG No edit summary current
- 14:0214:02, 4 December 2012 diff hist 0 N File:Sl2810gauche2.LOG No edit summary current
- 14:0214:02, 4 December 2012 diff hist 0 N File:Sl2810anti2.LOG No edit summary current
- 14:0114:01, 4 December 2012 diff hist 0 N File:Sl2810anti1.LOG No edit summary current
- 13:5513:55, 4 December 2012 diff hist +209 Rep:Mod:SSYL Computational Labs - Module 3 →Comparison of 1,5-Hexadiene Conformations
- 13:5213:52, 4 December 2012 diff hist +109 Rep:Mod:SSYL Computational Labs - Module 3 →Comparison of 1,5-Hexadiene Conformations
- 13:4213:42, 4 December 2012 diff hist +229 Rep:Mod:SSYL Computational Labs - Module 3 →D) Intrinsic Reaction Coordinate (IRC)
- 13:4013:40, 4 December 2012 diff hist +155 Rep:Mod:SSYL Computational Labs - Module 3 →D) Intrinsic Reaction Coordinate (IRC)
- 13:3713:37, 4 December 2012 diff hist 0 N File:Sl2810 44.png No edit summary current
- 13:3713:37, 4 December 2012 diff hist 0 N File:Sl2810 40.png No edit summary current
- 13:3713:37, 4 December 2012 diff hist 0 N File:Sl2810 34.png No edit summary current
- 13:3713:37, 4 December 2012 diff hist 0 N File:Sl2810 27.png No edit summary current
- 13:3713:37, 4 December 2012 diff hist 0 N File:Sl2810 19.png No edit summary current
- 13:3713:37, 4 December 2012 diff hist 0 N File:Sl2810 11.png No edit summary current
- 13:3713:37, 4 December 2012 diff hist 0 N File:Sl2810 10.png No edit summary current
- 13:3713:37, 4 December 2012 diff hist 0 N File:Sl2810 5.png No edit summary current
- 13:3713:37, 4 December 2012 diff hist 0 N File:Sl2810 1.png No edit summary current