User contributions for Zl11218
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8 May 2020
- 19:0119:01, 8 May 2020 diff hist +237 MRD:ZTSH0520 →HHF
- 18:5318:53, 8 May 2020 diff hist +513 MRD:ZTSH0520 →Reaction dynamics
- 18:4218:42, 8 May 2020 diff hist 0 N File:Latzl.PNG No edit summary current
- 16:5616:56, 8 May 2020 diff hist +86 MRD:ZTSH0520 →Observation when changing the initial momenta
- 16:4916:49, 8 May 2020 diff hist +322 MRD:ZTSH0520 →Reaction dynamics
- 16:4916:49, 8 May 2020 diff hist 0 File:Changezl.PNG Zl11218 uploaded a new version of File:Changezl.PNG current
- 16:4716:47, 8 May 2020 diff hist 0 N File:Changezl.PNG No edit summary
- 16:3916:39, 8 May 2020 diff hist +11 MRD:ZTSH0520 →Observation when changing the initial momenta
- 16:3916:39, 8 May 2020 diff hist +108 MRD:ZTSH0520 →Observation when changing the initial momenta
- 16:3816:38, 8 May 2020 diff hist 0 N File:Zuhu1.PNG No edit summary current
- 16:2716:27, 8 May 2020 diff hist +119 MRD:ZTSH0520 →Observation when changing the initial momenta
- 16:2016:20, 8 May 2020 diff hist +939 MRD:ZTSH0520 →Observation when changing the initial momenta
- 16:1816:18, 8 May 2020 diff hist 0 N File:Zuhu.PNG No edit summary current
- 15:4915:49, 8 May 2020 diff hist 0 N File:Zlinitial.PNG No edit summary current
- 15:3515:35, 8 May 2020 diff hist +38 MRD:ZTSH0520 →Locate the approximate position of the transition state
- 15:3315:33, 8 May 2020 diff hist +1,647 MRD:ZTSH0520 →Reaction dynamics
- 14:5614:56, 8 May 2020 diff hist +436 MRD:ZTSH0520 →Activation energy for both reactions
- 14:4814:48, 8 May 2020 diff hist 0 N File:Sadzl.PNG No edit summary current
- 14:4314:43, 8 May 2020 diff hist +491 MRD:ZTSH0520 →Activation energy for both reactions
- 14:4314:43, 8 May 2020 diff hist 0 N File:MepHHFzl.PNG No edit summary current
- 14:4214:42, 8 May 2020 diff hist 0 N File:MepFHHzl.PNG No edit summary current
- 08:4008:40, 8 May 2020 diff hist +160 MRD:ZTSH0520 →Reaction dynamics
- 05:0705:07, 8 May 2020 diff hist +30 MRD:ZTSH0520 No edit summary
- 04:1204:12, 8 May 2020 diff hist +31 MRD:ZTSH0520 →Activation energy for both reactions
- 04:0604:06, 8 May 2020 diff hist +380 MRD:ZTSH0520 →Activation energy for both reactions
- 04:0504:05, 8 May 2020 diff hist 0 N File:FHHzl.PNG No edit summary current
- 03:5903:59, 8 May 2020 diff hist 0 N File:HHF0zl.PNG No edit summary current
- 03:4803:48, 8 May 2020 diff hist 0 N File:HHFzl.PNG No edit summary current
- 03:4203:42, 8 May 2020 diff hist 0 N File:0zl.PNG No edit summary current
7 May 2020
- 19:1919:19, 7 May 2020 diff hist −80 MRD:ZTSH0520 →Activation energy for both reactions
- 18:5018:50, 7 May 2020 diff hist +848 MRD:ZTSH0520 →Exercise 2: F-H-H System
- 15:3815:38, 7 May 2020 diff hist +144 MRD:ZTSH0520 →By inspecting the potential energy surfaces, classify the F + H2 and H + HF reactions according to their energetics (endothermic or exothermic). How does this relate to the bond strength of the chemical species involved?
- 15:3415:34, 7 May 2020 diff hist +43 MRD:ZTSH0520 →Exercise 2: F-H-H System
- 15:3315:33, 7 May 2020 diff hist 0 N File:TS FHH HFF.PNG No edit summary current
- 15:2915:29, 7 May 2020 diff hist +85 MRD:ZTSH0520 →Locate the approximate position of the transition state.
- 15:1915:19, 7 May 2020 diff hist +538 MRD:ZTSH0520 No edit summary
- 15:1815:18, 7 May 2020 diff hist 0 N File:Energyzl.PNG No edit summary current
- 12:5412:54, 7 May 2020 diff hist +293 MRD:ZTSH0520 →Exercise 2: F-H-H System
- 12:5112:51, 7 May 2020 diff hist +496 MRD:ZTSH0520 →Reactive and unreactive trajectories
- 12:3912:39, 7 May 2020 diff hist +65 MRD:ZTSH0520 →Exercise 2: F-H-H System
- 09:4609:46, 7 May 2020 diff hist +316 MRD:ZTSH0520 →Set up a calculation where the initial positions correspond to the final positions of the trajectory, the same final momenta values but with their signs reversed. What do you observe?
- 09:2909:29, 7 May 2020 diff hist +5 MRD:ZTSH0520 →Set up a calculation where the initial positions correspond to the final positions of the trajectory, the same final momenta values but with their signs reversed. What do you observe?
- 09:2809:28, 7 May 2020 diff hist 0 N File:I40fszl.PNG No edit summary current
- 09:2709:27, 7 May 2020 diff hist 0 N File:40fs1zl.PNG No edit summary current
- 07:1407:14, 7 May 2020 diff hist +1,043 MRD:ZTSH0520 →Reactive and unreactive trajectories
6 May 2020
- 18:2018:20, 6 May 2020 diff hist +172 MRD:ZTSH0520 No edit summary
- 14:0814:08, 6 May 2020 diff hist +12 MRD:ZTSH0520 →Reactive and unreactive trajectories
- 14:0614:06, 6 May 2020 diff hist +1 MRD:ZTSH0520 →Reactive and unreactive trajectories
- 14:0314:03, 6 May 2020 diff hist +1,317 MRD:ZTSH0520 →Reactive and unreactive trajectories
- 11:4111:41, 6 May 2020 diff hist +687 MRD:ZTSH0520 No edit summary