User contributions for Sl2810
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29 November 2012
- 13:5313:53, 29 November 2012 diff hist 0 File:Sl2810bondmodified.png uploaded a new version of "File:Sl2810bondmodified.png" current
- 13:5113:51, 29 November 2012 diff hist 0 N File:Sl2810bondmodified.png No edit summary
- 13:5113:51, 29 November 2012 diff hist +95 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation of the Boat Transition State
- 13:4613:46, 29 November 2012 diff hist +69 Rep:Mod:SSYL Computational Labs - Module 3 →Opimisation using the QST2 Method
- 13:4613:46, 29 November 2012 diff hist +8 Rep:Mod:SSYL Computational Labs - Module 3 →Optimising the "Chair" and "Boat" Configurations
- 13:4613:46, 29 November 2012 diff hist +8 Rep:Mod:SSYL Computational Labs - Module 3 →Comparison of 1,5-Hexadiene Conformations
- 13:2113:21, 29 November 2012 diff hist +38 Rep:Mod:SSYL Computational Labs - Module 3 →A) Optimisation of Transition State
- 13:2013:20, 29 November 2012 diff hist +37 Rep:Mod:SSYL Computational Labs - Module 3 →C) Optimisation of the Terminal Bonds
- 13:2013:20, 29 November 2012 diff hist +37 Rep:Mod:SSYL Computational Labs - Module 3 →B) Optimisation using the Frozen Coordinate Method
- 13:1913:19, 29 November 2012 diff hist 0 N File:Sl2810reoptimisechair.png No edit summary current
- 13:1913:19, 29 November 2012 diff hist +5 Rep:Mod:SSYL Computational Labs - Module 3 →C) Optimisation of the Terminal Bonds
- 13:1813:18, 29 November 2012 diff hist +2 Rep:Mod:SSYL Computational Labs - Module 3 →C) Optimisation of the Terminal Bonds
- 13:1813:18, 29 November 2012 diff hist +11 Rep:Mod:SSYL Computational Labs - Module 3 →C) Optimisation of the Terminal Bonds
- 13:1713:17, 29 November 2012 diff hist +3 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation of Transition State
- 13:1713:17, 29 November 2012 diff hist +3 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation using the Frozen Coordinate Method
- 13:1713:17, 29 November 2012 diff hist +382 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation of the
- 13:1413:14, 29 November 2012 diff hist +383 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation of the
- 13:1313:13, 29 November 2012 diff hist +383 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation using the Frozen Coordinate Method
- 13:1313:13, 29 November 2012 diff hist +4 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation using the Frozen Coordinate Method
- 13:1213:12, 29 November 2012 diff hist +7 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation of the Chair Transition State
- 13:1113:11, 29 November 2012 diff hist +642 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation again
- 13:0913:09, 29 November 2012 diff hist +26 Rep:Mod:SSYL Computational Labs - Module 3 →==
- 13:0913:09, 29 November 2012 diff hist +6 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation using the Frozen Coordinate Method
- 12:5812:58, 29 November 2012 diff hist +6 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation using the Frozen Coordinate Method
- 12:5812:58, 29 November 2012 diff hist +56 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation using the Frozen Coordinate Method
- 12:5712:57, 29 November 2012 diff hist 0 N File:Sl2810frozencoor.png No edit summary current
- 12:5712:57, 29 November 2012 diff hist +1,054 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation using the Frozen Coordinate Method
- 12:3812:38, 29 November 2012 diff hist +37 Rep:Mod:SSYL Computational Labs - Module 3 →Optimising the "Chair" and "Boat" Configurations
- 12:3712:37, 29 November 2012 diff hist +37 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation of Anti 2 1,5-Hexadiene using a 6-31G(d) Basis Set
- 12:3712:37, 29 November 2012 diff hist −2 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation of Transition State
- 12:3612:36, 29 November 2012 diff hist +26 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation of Transition State
- 12:3612:36, 29 November 2012 diff hist +39 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation of Transition State
- 12:3512:35, 29 November 2012 diff hist +156 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation of Transition State
- 12:3312:33, 29 November 2012 diff hist +2 Rep:Mod:SSYL Computational Labs - Module 3 →Confirmation of Optimisation
- 12:3312:33, 29 November 2012 diff hist +48 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisating the Boat Transition State
- 12:3212:32, 29 November 2012 diff hist +48 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation using the Frozen Coordinate Method
- 12:3112:31, 29 November 2012 diff hist −58 Rep:Mod:SSYL Computational Labs - Module 3 →Re-optimising using the Frozen Coordinate Method
27 November 2012
- 14:0114:01, 27 November 2012 diff hist +57 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation using 3-21G Basis Set
- 14:0014:00, 27 November 2012 diff hist +45 Rep:Mod:SSYL Computational Labs - Module 3 →Optimisation of the Chair Transition State
- 13:4013:40, 27 November 2012 diff hist +132 Rep:Mod:SSYL Computational Labs - Module 3 →Optimising the "Chair" and "Boat" Configurations
- 13:3813:38, 27 November 2012 diff hist 0 Rep:Mod:SSYL Computational Labs - Module 3 →Optimising the "Chair" and "Boat" Configurations
- 13:3713:37, 27 November 2012 diff hist +9 Rep:Mod:SSYL Computational Labs - Module 3 →Optimising the "Chair" and "Boat" Configurations
- 13:3713:37, 27 November 2012 diff hist 0 Rep:Mod:SSYL Computational Labs - Module 3 →Optimising the "Chair" and "Boat" Configurations
- 13:3713:37, 27 November 2012 diff hist +6 Rep:Mod:SSYL Computational Labs - Module 3 →Optimising the "Chair" and "Boat" Configurations
- 13:3613:36, 27 November 2012 diff hist 0 N File:Sl2810imaginaryvib.gif No edit summary current
- 13:3613:36, 27 November 2012 diff hist +94 Rep:Mod:SSYL Computational Labs - Module 3 →Optimising the "Chair" and "Boat" Configurations
- 13:3413:34, 27 November 2012 diff hist +200 Rep:Mod:SSYL Computational Labs - Module 3 →Optimising the "Chair" and "Boat" Configurations
- 13:3213:32, 27 November 2012 diff hist +14 Rep:Mod:SSYL Computational Labs - Module 3 →Optimising the "Chair" and "Boat" Configurations
- 13:3213:32, 27 November 2012 diff hist +45 Rep:Mod:SSYL Computational Labs - Module 3 →Optimising the "Chair" and "Boat" Configurations
- 13:3213:32, 27 November 2012 diff hist 0 File:Sl2810chair.png uploaded a new version of "File:Sl2810chair.png" current