User contributions for Al1913
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23 October 2015
- 10:2110:21, 23 October 2015 diff hist +37 Rep:APL1995 →References
- 10:1710:17, 23 October 2015 diff hist +29 Rep:APL1995 →Secondary Orbital Overlap Effect
- 10:1310:13, 23 October 2015 diff hist +1 Rep:APL1995 →Background
22 October 2015
- 16:3716:37, 22 October 2015 diff hist +34,185 N Rep:Mod:APL1995 Created page with "==Introduction== The transition state of a reaction is the state which corresponds to the largest potential energy along the reaction coordinate. At this point, the species ca..."
- 16:3016:30, 22 October 2015 diff hist +11 Rep:APL1995 →Transition Structure Optimization
- 16:3016:30, 22 October 2015 diff hist −1 Rep:APL1995 →Secondary Orbital Overlap Effect
- 16:2916:29, 22 October 2015 diff hist −3 Rep:APL1995 →Secondary Orbital Overlap Effect
- 16:2916:29, 22 October 2015 diff hist −2 Rep:APL1995 →Bond Lengths
- 16:2816:28, 22 October 2015 diff hist −3 Rep:APL1995 →Transition Structure Optimization
- 16:2816:28, 22 October 2015 diff hist −3 Rep:APL1995 →Background
- 16:2716:27, 22 October 2015 diff hist −7 Rep:APL1995 →Transition Structure Optimization
- 16:2616:26, 22 October 2015 diff hist +3 Rep:APL1995 →Conclusion
- 16:2516:25, 22 October 2015 diff hist +5 Rep:APL1995 →Endo Transition State optimisation
- 16:2516:25, 22 October 2015 diff hist +5 Rep:APL1995 →Exo Transition State Optimisation
- 16:2416:24, 22 October 2015 diff hist +13 Rep:APL1995 →Transition Structure Optimization
- 16:2316:23, 22 October 2015 diff hist +22 Rep:APL1995 →Activation Energies
- 16:2216:22, 22 October 2015 diff hist +11 Rep:APL1995 →QST2 Boat Optimisation
- 16:2116:21, 22 October 2015 diff hist −3 Rep:APL1995 →Frozen Coordinates Chair Optimisation
- 16:2016:20, 22 October 2015 diff hist +4 Rep:APL1995 →HF/3-21G Chair Optimisation
- 16:1816:18, 22 October 2015 diff hist −4 Rep:APL1995 →Bond Angles
- 16:1816:18, 22 October 2015 diff hist +15 Rep:APL1995 →Bond Angles
- 16:1416:14, 22 October 2015 diff hist +22 Rep:APL1995 →Optimisation of 1,5-hexadiene conformers using HF/3-21G theory
- 16:1416:14, 22 October 2015 diff hist +63 Rep:APL1995 →Background
- 16:1116:11, 22 October 2015 diff hist +8 Rep:APL1995 →Background
- 16:0916:09, 22 October 2015 diff hist −12 Rep:APL1995 →The Diels Alder Cycloaddition
- 16:0816:08, 22 October 2015 diff hist 0 N File:DA reaction schemes AL.png No edit summary current
- 15:5315:53, 22 October 2015 diff hist 0 Rep:APL1995 →QST2 Boat Optimisation
- 15:5215:52, 22 October 2015 diff hist −1 Rep:APL1995 →QST2 Boat Optimisation
- 15:5215:52, 22 October 2015 diff hist +4 Rep:APL1995 →QST2 Boat Optimisation
- 15:4615:46, 22 October 2015 diff hist −125 Rep:APL1995 →Cyclohexa-1,3-diene/Maleic Anhydride Diels Alder reaction
- 15:4515:45, 22 October 2015 diff hist −93 Rep:APL1995 →Ethene/Cis-butadiene Diels Alder Reaction
- 15:4315:43, 22 October 2015 diff hist −156 Rep:APL1995 →Optimizing the "Chair" and "Boat" Transition Structures
- 15:4215:42, 22 October 2015 diff hist −36 Rep:APL1995 →Frequency analysis of an anti 1,5-hexadiene conformer
- 15:4215:42, 22 October 2015 diff hist −31 Rep:APL1995 →Optimisation of a anti 1,5-hexadiene conformer using B3LYP/6-31G* theory and comparisons to HF/3-21G theory
- 15:4115:41, 22 October 2015 diff hist −16 Rep:APL1995 →Optimisation of 1,5-hexadiene conformers using HF/3-21G theory
- 15:4115:41, 22 October 2015 diff hist −15 Rep:APL1995 →Optimisation of 1,5-hexadiene conformers using HF/3-21G theory
- 15:4015:40, 22 October 2015 diff hist −31 Rep:APL1995 No edit summary
- 15:3815:38, 22 October 2015 diff hist +29 Rep:APL1995 →Bond Angles
- 15:3215:32, 22 October 2015 diff hist −64 Rep:APL1995 →IRC
- 15:3215:32, 22 October 2015 diff hist +31 Rep:APL1995 →Background
- 15:3115:31, 22 October 2015 diff hist −28 Rep:APL1995 →Background
- 15:3115:31, 22 October 2015 diff hist +1 Rep:APL1995 →Background
- 15:3015:30, 22 October 2015 diff hist +1 Rep:APL1995 →References
- 15:3015:30, 22 October 2015 diff hist +1 Rep:APL1995 →References
- 15:3015:30, 22 October 2015 diff hist +144 Rep:APL1995 →References
- 15:2815:28, 22 October 2015 diff hist −13 Rep:APL1995 →Background
- 15:2515:25, 22 October 2015 diff hist +128 Rep:APL1995 No edit summary
- 15:2315:23, 22 October 2015 diff hist +199 Rep:APL1995 →References
- 15:1815:18, 22 October 2015 diff hist −6 Rep:APL1995 →References
- 15:1715:17, 22 October 2015 diff hist +27 Rep:APL1995 →Transition Structure Optimization