User contributions for Nf710
Appearance
9 June 2017
- 14:3714:37, 9 June 2017 diff hist +128 MRD:Na2615 →Polanyi's empirical rules
- 12:5112:51, 9 June 2017 diff hist +185 MRD:Na2615 →Locating the Transition state
- 12:4212:42, 9 June 2017 diff hist +145 MRD:Hajera →10. 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. current
- 12:2512:25, 9 June 2017 diff hist +185 MRD:Hajera →1. What value does the total gradient of the potential energy surface have at a minimum and at a transition structure? Briefly explain how minima and transition structures can be distinguished using the curvature of the potential energy surface.
- 12:1912:19, 9 June 2017 diff hist +41 MRD:ambs1015 →Q10 current
- 12:1812:18, 9 June 2017 diff hist +156 MRD:ambs1015 →Q10
- 11:5911:59, 9 June 2017 diff hist +211 MRD:ambs1015 →Q9
- 11:3911:39, 9 June 2017 diff hist +224 MRD:ambs1015 →Exercise 1: H + H2 system
- 11:2711:27, 9 June 2017 diff hist +262 RW1515 MRD →References current
- 10:5010:50, 9 June 2017 diff hist +239 RW1515 MRD →H2 + H Reaction
- 10:3910:39, 9 June 2017 diff hist +267 MRD:js6815 →Conclusion current
- 10:3810:38, 9 June 2017 diff hist +145 MRD:js6815 →Conclusion
- 10:3310:33, 9 June 2017 diff hist +121 MRD:js6815 →Reaction Dynamics
- 09:3509:35, 9 June 2017 diff hist +179 MRD:js6815 →locating the transition state
- 09:3009:30, 9 June 2017 diff hist +262 MRD:tfi15 →References current
- 09:1909:19, 9 June 2017 diff hist +146 MRD:tfi15 →H + HF Reaction
- 08:4608:46, 9 June 2017 diff hist +128 MRD:tfi15 →Best estimate of the transition state position (rts)
2 June 2017
- 18:0418:04, 2 June 2017 diff hist +274 MRD:felixdcifd915 →References: current
- 18:0118:01, 2 June 2017 diff hist +128 MRD:felixdcifd915 →Reaction Dynamics:
- 17:5817:58, 2 June 2017 diff hist +126 MRD:felixdcifd915 →Exercise 2:
- 17:4517:45, 2 June 2017 diff hist +251 MRD:felixdcifd915 →Briefly explain how minima and transition structures can be distinguished using the curvature of the potential energy surface?
- 17:4117:41, 2 June 2017 diff hist +152 MRD:mn915 →Reactive Trajectories for H + H-F system current
- 17:3917:39, 2 June 2017 diff hist +115 MRD:mn915 →Reaction Dynamics
- 17:3217:32, 2 June 2017 diff hist +161 MRD:mn915 →F + H2 and H + HF systems
- 16:5216:52, 2 June 2017 diff hist +127 MRD:em2815 →References current
- 16:5116:51, 2 June 2017 diff hist +134 MRD:em2815 →References
- 16:1216:12, 2 June 2017 diff hist +392 Jd26154 →References current
- 16:0916:09, 2 June 2017 diff hist +198 Jd26154 →References
- 16:0516:05, 2 June 2017 diff hist +199 Jd26154 →Exercise Two
- 15:5515:55, 2 June 2017 diff hist +328 Jd26154 →Exercise Two
- 15:5215:52, 2 June 2017 diff hist +107 Jd26154 →Exercise Two
- 15:4615:46, 2 June 2017 diff hist +52 Jd26154 No edit summary Tag: Visual edit
- 15:4315:43, 2 June 2017 diff hist +200 Jd26154 →Exercise One
- 15:4015:40, 2 June 2017 diff hist +114 Jd26154 →Exercise One
- 15:3615:36, 2 June 2017 diff hist +283 MRD:ksg115 →References current
- 15:1215:12, 2 June 2017 diff hist +118 MRD:ksg115 →Transition State Estimations
- 15:0615:06, 2 June 2017 diff hist +148 Rep:Mod:Yts15 →Conclusion
- 15:0215:02, 2 June 2017 diff hist +86 Rep:Mod:Yts15 →Reaction dynamics
- 14:5614:56, 2 June 2017 diff hist +135 Rep:Mod:Yts15 →Reaction 2: F-H-H system
- 14:4214:42, 2 June 2017 diff hist +162 Rep:Mod:Yts15 →Trajectories from r1 = r2: locating the transition state
- 14:3914:39, 2 June 2017 diff hist +121 MRD:RLJ1501083003 →References current
26 May 2017
- 15:3015:30, 26 May 2017 diff hist +215 MRD:js5515physcomp →References current
- 15:2715:27, 26 May 2017 diff hist +137 MRD:js5515physcomp →Question E
- 15:2315:23, 26 May 2017 diff hist +113 MRD:js5515physcomp →Exercise 2: F-H-H system
- 15:1915:19, 26 May 2017 diff hist +202 MRD:js5515physcomp →Question B
- 15:1615:16, 26 May 2017 diff hist +106 Gmj →Reference current
- 15:1415:14, 26 May 2017 diff hist +156 Gmj →Reaction Efficiency
- 15:1115:11, 26 May 2017 diff hist +116 Gmj →Reaction 2: F-H-H system
- 15:0315:03, 26 May 2017 diff hist +165 Gmj →Determination of transition state
- 11:0511:05, 26 May 2017 diff hist +219 Rep:Mod:XZ9215 second →Reactive and unreactive trajectories