User contributions for Jas213

28 May 2018

• 12:4912:49, 28 May 2018 diff hist +308 MRD:gs2016 →Exercise 1
• 12:4712:47, 28 May 2018 diff hist +464 MRD:gs2016 →Exercise 1
• 12:4412:44, 28 May 2018 diff hist +458 MRD:gs2016 →Exercise 1
• 12:3812:38, 28 May 2018 diff hist +245 MRD:pes116 →Polanyi's empirical rules current
• 12:3712:37, 28 May 2018 diff hist +201 MRD:pes116 →Polanyi's empirical rules
• 12:3412:34, 28 May 2018 diff hist +174 MRD:pes116 →Polanyi's empirical rules
• 12:3212:32, 28 May 2018 diff hist +259 MRD:pes116 →Activation Energy
• 12:2912:29, 28 May 2018 diff hist +259 MRD:pes116 →F - H - H system
• 12:2812:28, 28 May 2018 diff hist +202 MRD:pes116 →Reactive and unreactive trajectories
• 12:2712:27, 28 May 2018 diff hist +270 MRD:pes116 →Transition State Theory
• 12:2412:24, 28 May 2018 diff hist +331 MRD:pes116 →Locating the transition state
• 12:2112:21, 28 May 2018 diff hist +321 MRD:pes116 →Transition States
• 12:1412:14, 28 May 2018 diff hist +180 MRD:19970410 →Reaction dynamics current
• 12:0912:09, 28 May 2018 diff hist +258 MRD:19970410 →Reaction dynamics
• 12:0612:06, 28 May 2018 diff hist +272 MRD:19970410 →Transition state coordination
• 12:0312:03, 28 May 2018 diff hist +208 MRD:19970410 →PES Inspection
• 10:1810:18, 28 May 2018 diff hist +215 MRD:19970410 →Assumption of Transition state
• 10:1710:17, 28 May 2018 diff hist +211 MRD:19970410 →Reactive and Unreactive trajectories
• 10:1510:15, 28 May 2018 diff hist +138 MRD:19970410 →Reactive and Unreactive trajectories
• 10:1410:14, 28 May 2018 diff hist +255 MRD:19970410 →Reactive and Unreactive trajectories
• 10:0210:02, 28 May 2018 diff hist +266 MRD:19970410 →MEP and Dynamic calculation

25 May 2018

• 17:0117:01, 25 May 2018 diff hist +25 MRD:19970410 No edit summary
• 17:0017:00, 25 May 2018 diff hist +198 MRD:19970410 →Transition state location
• 16:4916:49, 25 May 2018 diff hist +266 MRD:LH1216 →Reactive and unreactive trajectories current
• 16:4516:45, 25 May 2018 diff hist +131 MRD:LH1216 →Reactive and unreactive trajectories
• 16:4116:41, 25 May 2018 diff hist +93 MRD:LH1216 →Trajectories from r1 = r2: locating the transition state
• 16:4116:41, 25 May 2018 diff hist +133 MRD:LH1216 →Trajectories from r1 = r2: locating the transition state
• 16:3416:34, 25 May 2018 diff hist +151 MRD:nk1016 →Exercise 2: F-H-H system current
• 16:3216:32, 25 May 2018 diff hist +271 MRD:nk1016 →Exercise 2: F-H-H system
• 16:3016:30, 25 May 2018 diff hist +71 MRD:nk1016 No edit summary
• 16:2916:29, 25 May 2018 diff hist 0 MRD:nk1016 →Exercise 2: F-H-H system
• 16:2716:27, 25 May 2018 diff hist +197 MRD:nk1016 →Exercise 2: F-H-H system
• 16:2516:25, 25 May 2018 diff hist −5 MRD:nk1016 →Exercise 2: F-H-H system
• 16:2516:25, 25 May 2018 diff hist +244 MRD:nk1016 →Exercise 2: F-H-H system
• 16:2116:21, 25 May 2018 diff hist −2 MRD:nk1016 →Exercise 1: H + H2 System
• 16:2116:21, 25 May 2018 diff hist +26 MRD:nk1016 →Exercise 1: H + H2 System
• 16:2016:20, 25 May 2018 diff hist +179 MRD:nk1016 →Exercise 1: H + H2 System
• 16:1816:18, 25 May 2018 diff hist +614 MRD:nk1016 →Exercise 1: H + H2 System
• 16:1316:13, 25 May 2018 diff hist +520 MRD:nk1016 No edit summary

16 May 2018

• 23:3423:34, 16 May 2018 diff hist +445 MRD:triatomic systems sb1016 →Reactive Trajectories
• 23:2823:28, 16 May 2018 diff hist +159 MRD:triatomic systems sb1016 →MEP Analysis
• 23:2623:26, 16 May 2018 diff hist +241 MRD:triatomic systems sb1016 →Transition State

15 May 2018

• 14:2514:25, 15 May 2018 diff hist +416 MRD:01188093 →Locate the approximate position of the transition state. current
• 14:2314:23, 15 May 2018 diff hist +193 MRD:01188093 →Reactive and Unreactive Pathways
• 14:2214:22, 15 May 2018 diff hist +196 MRD:01188093 →Discuss how the distribution of energy between different modes (translation and vibration) affect the efficiency of the reaction, and how this is influenced by the position of the transition state.
• 14:1814:18, 15 May 2018 diff hist −33 MRD:01188093 →Reactive and Unreactive Pathways
• 14:0414:04, 15 May 2018 diff hist +139 MRD:01188093 →F H - H System
• 14:0014:00, 15 May 2018 diff hist +427 MRD:01188093 →Energetics
• 13:5613:56, 15 May 2018 diff hist +155 MRD:01188093 →Main Assumptions of Transition State Theory
• 13:5213:52, 15 May 2018 diff hist +708 MRD:01188093 →Reactive and Unreactive Pathways