User contributions for Clc409
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19 February 2012
- 00:2600:26, 19 February 2012 diff hist +430 Rep:Mod:chilong module3 →IRC
- 00:2100:21, 19 February 2012 diff hist +593 Rep:Mod:chilong module3 →Products optimization
- 00:1100:11, 19 February 2012 diff hist +879 Rep:Mod:chilong module3 →Cope
17 February 2012
- 17:4017:40, 17 February 2012 diff hist +203 Rep:Mod:chilong module3 →IRC
- 17:3717:37, 17 February 2012 diff hist +220 Rep:Mod:chilong module3 →Structure Optimization
- 17:3417:34, 17 February 2012 diff hist +126 Rep:Mod:chilong module3 →Structure Optimization
- 17:3317:33, 17 February 2012 diff hist +47 Rep:Mod:chilong module3 →Products
- 17:3217:32, 17 February 2012 diff hist +47 Rep:Mod:chilong module3 →Optimization
- 17:3117:31, 17 February 2012 diff hist +126 Rep:Mod:chilong module3 →Reactants
- 17:2617:26, 17 February 2012 diff hist +255 Rep:Mod:chilong module3 →IRC
- 17:1917:19, 17 February 2012 diff hist +204 Rep:Mod:chilong module3 →Results summary
- 17:1417:14, 17 February 2012 diff hist +63 Rep:Mod:chilong module3 →Force Constant Matrix (FCM)
- 16:5916:59, 17 February 2012 diff hist +26 Rep:Mod:chilong module3 →Optimization
- 16:5916:59, 17 February 2012 diff hist +68 Rep:Mod:chilong module3 →Optimization
- 16:5716:57, 17 February 2012 diff hist +71 Rep:Mod:chilong module3 →Molecular Orbitals
- 16:5616:56, 17 February 2012 diff hist +41 Rep:Mod:chilong module3 →Optimization
- 16:5316:53, 17 February 2012 diff hist +23 Rep:Mod:chilong module3 →MOs and Vibration
- 16:5116:51, 17 February 2012 diff hist +551 Rep:Mod:chilong module3 →QST2 Calculation
- 16:4016:40, 17 February 2012 diff hist 0 Rep:Mod:chilong module3 →MOs and Vibration
- 16:3916:39, 17 February 2012 diff hist +387 Rep:Mod:chilong module3 →MOs and Vibration
- 16:3116:31, 17 February 2012 diff hist +243 Rep:Mod:chilong module3 →MOs and Vibration
- 16:2916:29, 17 February 2012 diff hist +129 Rep:Mod:chilong module3 →MOs and Vibration
- 16:2716:27, 17 February 2012 diff hist +877 Rep:Mod:chilong module3 →Structure Optimization
- 16:1416:14, 17 February 2012 diff hist +815 Rep:Mod:chilong module3 →Molecular Orbitals
- 15:5715:57, 17 February 2012 diff hist +24 Rep:Mod:chilong module3 →Molecular Orbitals
- 15:4415:44, 17 February 2012 diff hist +81 Rep:Mod:chilong module3 →Products optimization
- 15:4115:41, 17 February 2012 diff hist +217 Rep:Mod:chilong module3 →IRC
- 15:3615:36, 17 February 2012 diff hist 0 N File:Boat IRCalways Prostruc.PNG No edit summary current
- 15:3615:36, 17 February 2012 diff hist 0 N File:Boat IRCalways struc.mol No edit summary current
- 15:3315:33, 17 February 2012 diff hist +131 Rep:Mod:chilong module3 →IRC
- 15:2915:29, 17 February 2012 diff hist +371 Rep:Mod:chilong module3 →Reaction pathway
- 15:2215:22, 17 February 2012 diff hist 0 Rep:Mod:chilong module3 →Activation Energies (Ea)
- 15:2215:22, 17 February 2012 diff hist +585 Rep:Mod:chilong module3 →Activation Energies (Ea)
- 15:1415:14, 17 February 2012 diff hist +532 Rep:Mod:chilong module3 →Activation Energies (Ea)
- 15:0415:04, 17 February 2012 diff hist +219 Rep:Mod:chilong module3 →Activation Energies (Ea)
- 14:5814:58, 17 February 2012 diff hist 0 Rep:Mod:chilong module3 →Molecular Orbitals
- 14:5414:54, 17 February 2012 diff hist +121 Rep:Mod:chilong module3 →Activation Energies
- 14:4914:49, 17 February 2012 diff hist +18 Rep:Mod:chilong module3 →Reactants
- 14:4614:46, 17 February 2012 diff hist +5 Rep:Mod:chilong module3 →Force Constant Matrix (FCM)
- 14:4214:42, 17 February 2012 diff hist +15 Rep:Mod:chilong module3 →IRC
- 14:2814:28, 17 February 2012 diff hist +53 Rep:Mod:chilong module3 →IRC
- 14:2614:26, 17 February 2012 diff hist 0 N File:B3LYP endo prostruc.mol No edit summary current
- 14:2614:26, 17 February 2012 diff hist 0 N File:DFT DA endo IRC prostruc.PNG No edit summary current
- 14:2614:26, 17 February 2012 diff hist 0 N File:DFT DA endo IRC graph.PNG No edit summary current
- 14:2114:21, 17 February 2012 diff hist 0 N File:DFT IRC EXO MOVIE.gif No edit summary current
- 14:2114:21, 17 February 2012 diff hist 0 N File:DFT DA EXO IRC GRaph.PNG No edit summary current
- 14:2114:21, 17 February 2012 diff hist 0 N File:DFT DA EXO IRC ProStruc.mol No edit summary current
- 14:2114:21, 17 February 2012 diff hist 0 N File:DFT DA EXO IRC ProStruc.PNG No edit summary current
- 14:1114:11, 17 February 2012 diff hist 0 N File:AM1 Endo IRC GRaph.PNG No edit summary current
- 14:1114:11, 17 February 2012 diff hist 0 N File:AM1 Endo IRC product.mol No edit summary current