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31 October 2013
- 16:0116:01, 31 October 2013 diff hist 0 N File:Diels alder TS qst2 PIPH.log No edit summary current
- 15:5915:59, 31 October 2013 diff hist +156 Rep:Mod:PAHPhysical156 →Butadiene + ethylene Diels Alder
- 15:5815:58, 31 October 2013 diff hist 0 N File:Ethylene butadiene LUMO.png No edit summary current
- 15:5815:58, 31 October 2013 diff hist 0 N File:Ethylene butadiene HOMO.png No edit summary current
- 15:4615:46, 31 October 2013 diff hist +240 Rep:Mod:PAHPhysical156 →cis-butadiene
- 15:4515:45, 31 October 2013 diff hist 0 N File:Butadiene LUMOPH.png No edit summary current
- 15:4515:45, 31 October 2013 diff hist 0 N File:Butadiene HOMOPH.png No edit summary current
- 15:1815:18, 31 October 2013 diff hist +97 Rep:Mod:PAHPhysical156 →cis-butadiene
- 15:1715:17, 31 October 2013 diff hist 0 N File:Cis butadiene 631GdPIPH.log No edit summary current
- 15:1715:17, 31 October 2013 diff hist 0 N File:Cis butadiene 321GPIPH.log No edit summary current
- 15:0715:07, 31 October 2013 diff hist +191 Rep:Mod:PAHPhysical156 →cis-butadiene
- 15:0315:03, 31 October 2013 diff hist +442 Rep:Mod:PAHPhysical156 →Diels-Alder reactions
- 14:5914:59, 31 October 2013 diff hist +6 Rep:Mod:PAHPhysical156 →cis-butadiene
- 14:5914:59, 31 October 2013 diff hist 0 N File:MO sketch cis butadienePIPH.jpg No edit summary current
- 14:4814:48, 31 October 2013 diff hist +17 Rep:Mod:PAHPhysical156 →A more complex basis set
- 14:3614:36, 31 October 2013 diff hist +17 Rep:Mod:PAHPhysical156 →A more complex basis set
- 14:1714:17, 31 October 2013 diff hist +51 Rep:Mod:PAHPhysical156 →The Intrinsic Reaction Coordinate (IRC) method
- 14:1714:17, 31 October 2013 diff hist +45 Rep:Mod:PAHPhysical156 →The Intrinsic Reaction Coordinate (IRC) method
- 14:1614:16, 31 October 2013 diff hist 0 N File:Chair IRC GraphPIPH.png No edit summary current
- 14:1314:13, 31 October 2013 diff hist +256 Rep:Mod:PAHPhysical156 →A more complex basis set
- 14:0114:01, 31 October 2013 diff hist +793 Rep:Mod:PAHPhysical156 →A more complex basis set
- 13:5613:56, 31 October 2013 diff hist 0 N File:Anti2 6-31G PIPH.log No edit summary current
- 13:5413:54, 31 October 2013 diff hist 0 N File:Boat 631GPIPH.log No edit summary
- 13:5413:54, 31 October 2013 diff hist 0 N File:Chair-631GPIPH.log No edit summary current
- 13:5213:52, 31 October 2013 diff hist +528 Rep:Mod:PAHPhysical156 →The Intrinsic Reaction Coordinate (IRC) method
- 13:4813:48, 31 October 2013 diff hist +955 Rep:Mod:PAHPhysical156 →The Boat transition state
- 13:4713:47, 31 October 2013 diff hist 0 N File:Chair opt IRC1PIPH.log No edit summary current
- 13:3813:38, 31 October 2013 diff hist 0 N File:Chair IRC PIPH.gif No edit summary current
- 13:3513:35, 31 October 2013 diff hist +842 Rep:Mod:PAHPhysical156 →The chair and boat structures
30 October 2013
- 22:1822:18, 30 October 2013 diff hist +1,255 Rep:Mod:PAHPhysical156 →The chair and boat structures
- 22:1522:15, 30 October 2013 diff hist 0 N File:Boat qst2PIPH.log No edit summary current
- 22:1122:11, 30 October 2013 diff hist 0 N File:Boat TS ImagePIPH.png No edit summary current
- 21:4121:41, 30 October 2013 diff hist +1,508 Rep:Mod:PAHPhysical156 No edit summary
- 21:3621:36, 30 October 2013 diff hist 0 N File:Chair frozencoord hessianPIPH.log No edit summary current
- 21:3521:35, 30 October 2013 diff hist 0 N File:Chair frozencoordPIPH.log No edit summary current
- 21:2821:28, 30 October 2013 diff hist 0 N File:Frozencoord hessian chairPIPH.png No edit summary current
- 21:1921:19, 30 October 2013 diff hist 0 N File:Chair opt freq2PIPH.log No edit summary current
- 21:1521:15, 30 October 2013 diff hist +83 Rep:Mod:PAHPhysical156 →The chair and boat structures
- 21:0821:08, 30 October 2013 diff hist +481 Rep:Mod:PAHPhysical156 →The chair and boat structures
- 21:0021:00, 30 October 2013 diff hist +296 Rep:Mod:PAHPhysical156 →Optimising the reactants and products
- 20:5820:58, 30 October 2013 diff hist +269 Rep:Mod:PAHPhysical156 →The chair and boat structures
- 20:5320:53, 30 October 2013 diff hist +50 Rep:Mod:PAHPhysical156 →Optimising the reactants and products
- 20:5220:52, 30 October 2013 diff hist +484 Rep:Mod:PAHPhysical156 →Optimising the reactants and products
- 20:3920:39, 30 October 2013 diff hist +1,248 Rep:Mod:PAHPhysical156 →Optimising the reactants and products
- 20:3620:36, 30 October 2013 diff hist 0 N File:Hexadiene anti2 DFT freqPIPH.log No edit summary current
- 20:3420:34, 30 October 2013 diff hist 0 N File:Hexadiene anti2 DFT PIPH.log No edit summary current
- 20:2920:29, 30 October 2013 diff hist 0 N File:Hexadiene 321G anti2PIPH.log No edit summary current
- 20:2720:27, 30 October 2013 diff hist 0 N File:Hexadiene 3-21G gauchePIPH.log No edit summary current
- 20:2320:23, 30 October 2013 diff hist +454 Rep:Mod:PAHPhysical156 →Optimising the reactants and products
- 20:1820:18, 30 October 2013 diff hist +699 Rep:Mod:PAHPhysical156 →Optimising the reactants and products