User contributions for Awc106

23 February 2009

• 12:2312:23, 23 February 2009 diff hist 0 N File:Butadiene.jpg No edit summary
• 12:2312:23, 23 February 2009 diff hist +2 Rep:Mod:awc106 module part2 →Table 1: Molecular Orbitals of Cis-Butadiene
• 12:2312:23, 23 February 2009 diff hist +251 Rep:Mod:awc106 module part2 →The Diels Alder Cycloaddition
• 12:0712:07, 23 February 2009 diff hist 0 Rep:Mod:awc106 module3 →Optimising the Boat Transition Structure
• 12:0412:04, 23 February 2009 diff hist +482 Rep:Mod:awc106 module3 →Activation Energies
• 11:5611:56, 23 February 2009 diff hist +17 Rep:Mod:awc106 module3 →Activation Energies
• 11:5411:54, 23 February 2009 diff hist 0 N File:Chair ts b3lyp 631g.jpg No edit summary current
• 11:5411:54, 23 February 2009 diff hist +67 Rep:Mod:awc106 module3 →Activation Energies
• 11:5311:53, 23 February 2009 diff hist 0 N File:BOAT TS REOPT FREQ2.LOG No edit summary current
• 11:5211:52, 23 February 2009 diff hist +6 Rep:Mod:awc106 module3 →Table 1: Activation Energies of Transition States
• 11:5111:51, 23 February 2009 diff hist 0 Rep:Mod:awc106 module3 →Table 1: Activation Energies of Transition States
• 11:5111:51, 23 February 2009 diff hist 0 Rep:Mod:awc106 module3 →Activation Energies
• 11:5011:50, 23 February 2009 diff hist +88 Rep:Mod:awc106 module3 →Table 1: Activation Energies of Transition States
• 11:3711:37, 23 February 2009 diff hist +1,297 N Rep:Mod:awc106 module3 part2 New page: ==The Diels Alder Cycloaddition== {| border="2" cellpadding="20" cellspacing="0" align="center" |colspan="4"| ====Table 1: Initial Optimisation of Anti 1,5-hexadiene==== |- |align="cente...
• 11:2611:26, 23 February 2009 diff hist +25 Rep:Mod:awc106 module part2 →The Diels Alder Cycloaddition
• 11:2511:25, 23 February 2009 diff hist +842 Rep:Mod:awc106 module part2 →The Diels Alder Cycloaddition
• 11:1711:17, 23 February 2009 diff hist +397 Rep:Mod:awc106 module part2 →The Diels Alder Cycloaddition
• 11:1611:16, 23 February 2009 diff hist +33 N Rep:Mod:awc106 module part2 New page: ==The Diels Alder Cycloaddition==
• 11:0611:06, 23 February 2009 diff hist +52 Rep:Mod:awc106 module3 →Optimising the Boat Transition Structure
• 10:5410:54, 23 February 2009 diff hist −19 Rep:Mod:awc106 module3 →Module 3: The Transition State
• 10:5310:53, 23 February 2009 diff hist +10 Rep:Mod:awc106 module3 →Activation Energies
• 10:4410:44, 23 February 2009 diff hist +424 Rep:Mod:awc106 module3 →Optimising the Boat Transition Structure
• 10:3610:36, 23 February 2009 diff hist +61 Rep:Mod:awc106 module3 →Activation Energies
• 10:3510:35, 23 February 2009 diff hist 0 N File:BOAT TS REOPT.LOG No edit summary current
• 10:3510:35, 23 February 2009 diff hist +1 Rep:Mod:awc106 module3 →Table 1: B3LYP/6-31G Optimisation of Transition States
• 10:3410:34, 23 February 2009 diff hist 0 N File:Boat ts b3lyp 631g.jpg No edit summary current
• 10:3310:33, 23 February 2009 diff hist 0 Rep:Mod:awc106 module3 →Table 1: Initial Optimisation of Transition State
• 10:3210:32, 23 February 2009 diff hist +862 Rep:Mod:awc106 module3 →Optimising the Boat Transition Structure
• 10:2410:24, 23 February 2009 diff hist +59 Rep:Mod:awc106 module3 →Optimising the Boat Transition Structure
• 10:2310:23, 23 February 2009 diff hist 0 N File:BOAT TS OPT.LOG No edit summary
• 10:2310:23, 23 February 2009 diff hist +295 Rep:Mod:awc106 module3 →Optimising the Boat Transition Structure
• 10:2010:20, 23 February 2009 diff hist 0 Rep:Mod:awc106 module3 →Table 1: Initial Optimisation of Transition State
• 10:2010:20, 23 February 2009 diff hist 0 N File:Chair ts qst2.jpg No edit summary current
• 10:1310:13, 23 February 2009 diff hist +14 Rep:Mod:awc106 module3 →Optimising the Boat Transition Structure
• 10:1310:13, 23 February 2009 diff hist 0 N File:Boat atomlist.jpg No edit summary current
• 10:1210:12, 23 February 2009 diff hist +6 Rep:Mod:awc106 module3 →Optimising the Boat Transition Structure

19 February 2009

• 11:0311:03, 19 February 2009 diff hist +529 Rep:Mod:awc106 module3 →Optimising the Boat Transition Structure
• 11:0111:01, 19 February 2009 diff hist +610 Rep:Mod:awc106 module3 →Activation Energies
• 10:5410:54, 19 February 2009 diff hist +515 Rep:Mod:awc106 module3 →Activation Energies
• 10:5210:52, 19 February 2009 diff hist +302 Rep:Mod:awc106 module3 →Optimising the Boat Transition Structure

18 February 2009

• 19:1619:16, 18 February 2009 diff hist −3 Rep:Mod:awc106 module3 →Optimising Reactants and Products
• 18:5318:53, 18 February 2009 diff hist +77 Rep:Mod:awc106 module3 →Optimising the Boat Transition Structure
• 18:5218:52, 18 February 2009 diff hist 0 N File:Boat ts1.jpg No edit summary current
• 18:5118:51, 18 February 2009 diff hist 0 N File:Anti ts1.jpg No edit summary current
• 18:5118:51, 18 February 2009 diff hist +468 Rep:Mod:awc106 module3 →Optimising the Boat Transition Structure
• 18:3718:37, 18 February 2009 diff hist +33 Rep:Mod:awc106 module3 →Optimising the Boat Transition Structure
• 18:3418:34, 18 February 2009 diff hist +371 Rep:Mod:awc106 module3 →Optimising the Boat Transition Structure
• 18:2918:29, 18 February 2009 diff hist +39 Rep:Mod:awc106 module3 →Optimising the Chair and Boat Transition Structures
• 17:4717:47, 18 February 2009 diff hist +68 Rep:Mod:awc106 module3 →Optimising the Chair and Boat Transition Structures
• 17:4717:47, 18 February 2009 diff hist 0 N File:CHAIR TS DERIVATIVE.LOG No edit summary current