Jump to content

User contributions for Zn4318

Results for Zn4318 talk block log uploads logs

A user with 178 edits. Account created on 11 March 2019.

22:5822:58, 22 May 2020 diff hist +14 MRD:ZN 01510257 →Q9)In light of the fact that energy is conserved, discuss the mechanism of release of the reaction energy. Explain how this could be confirmed experimentally. Tag: Visual edit
22:5322:53, 22 May 2020 diff hist +566 MRD:ZN 01510257 →Q8) Report the activation energy for both reactions. Tag: Visual edit
22:4722:47, 22 May 2020 diff hist +388 MRD:ZN 01510257 →Q10)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 Tag: Visual edit
22:4322:43, 22 May 2020 diff hist +1,598 MRD:ZN 01510257 →Q10)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 Tag: Visual edit
22:2922:29, 22 May 2020 diff hist +102 MRD:ZN 01510257 →Q10)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 Tag: Visual edit
22:2622:26, 22 May 2020 diff hist +1,705 MRD:ZN 01510257 →Q9)In light of the fact that energy is conserved, discuss the mechanism of release of the reaction energy. Explain how this could be confirmed experimentally. Tag: Visual edit
22:0722:07, 22 May 2020 diff hist +46 N File:ZN 01510257 Q9 Figure 4.png Energy vs time plot of successful HF formation current
22:0422:04, 22 May 2020 diff hist +42 N File:ZN 01510257 Q9 Figure 2.png Surface plot of successful F + H2 reaction current
21:5821:58, 22 May 2020 diff hist +48 N File:ZN 01510257 Q9 Figure 1.png Contour plot for a successful F + H2 trajectory. current
21:5021:50, 22 May 2020 diff hist +685 MRD:ZN 01510257 →Q10)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 Tag: Visual edit
21:4921:49, 22 May 2020 diff hist +24 N File:ZN 01510257 Q10 Figure7 2.gif The 7th gif in the table current
21:4721:47, 22 May 2020 diff hist +24 N File:ZN 01510257 Q10 Figure6 2.gif The 6th gif in the table current
21:4621:46, 22 May 2020 diff hist +24 N File:ZN 01510257 Q10 Figure5 2.gif The 5th gif in the table current
21:4521:45, 22 May 2020 diff hist +24 N File:ZN 01510257 Q10 Figure4 2.gif The 4th gif in the table current
21:4421:44, 22 May 2020 diff hist +24 N File:ZN 01510257 Q10 Figure3 2.gif The 3rd gif in the table current
21:4421:44, 22 May 2020 diff hist +27 N File:ZN 01510257 Q10 Figure2 2.gif The second gif in the table current
21:4321:43, 22 May 2020 diff hist +24 N File:ZN 01510257 Q10 Figure1 2.gif The 1st gif in the table current
21:4221:42, 22 May 2020 diff hist +33 N File:ZN 01510257 Q10 Figure 7 1.png The 7th contour plot in the table current
21:4121:41, 22 May 2020 diff hist +33 N File:ZN 01510257 Q10 Figure 6 1.png The 6th contour plot in the table current
21:4021:40, 22 May 2020 diff hist +35 N File:ZN 01510257 Q10 Figure 5 1.png The fifth contour plot in the table current
21:4021:40, 22 May 2020 diff hist +33 N File:ZN 01510257 Q10 Figure 4 1.png The 4th contour plot in the table current
21:3921:39, 22 May 2020 diff hist +35 N File:ZN 01510257 Q10 Figure 3 1.png The third contour plot in the table current
21:3821:38, 22 May 2020 diff hist +36 N File:ZN 01510257 Q10 Figure 2 1.png The second contour plot in the table current
21:3721:37, 22 May 2020 diff hist +35 N File:ZN 01510257 Q10 Figure 1 1.png The first contour plot in the table current
21:3521:35, 22 May 2020 diff hist +775 MRD:ZN 01510257 →Q8) Report the activation energy for both reactions. Tag: Visual edit
21:1821:18, 22 May 2020 diff hist +1,139 MRD:ZN 01510257 →Q8) Report the activation energy for both reactions. Tag: Visual edit
21:1321:13, 22 May 2020 diff hist +46 N File:ZN 01510257 Q8 Figure 2 2.png Energy vs time plot of 2nd situation zoomed in current
21:1021:10, 22 May 2020 diff hist 0 File:ZN 01510257 Q8 Figure 2 1.png Zn4318 uploaded a new version of File:ZN 01510257 Q8 Figure 2 1.png current
21:1021:10, 22 May 2020 diff hist +37 N File:ZN 01510257 Q8 Figure 2 1.png Energy vs time plot for 2nd situation
21:0921:09, 22 May 2020 diff hist +49 N File:ZN 01510257 Q8 Figure 1 2.png Energy vs time plot zoomed in for first situation current
21:0821:08, 22 May 2020 diff hist +41 N File:ZN 01510257 Q8 Figure 1 1.png Energy vs time plot for the first system. current
20:4220:42, 22 May 2020 diff hist −52 MRD:ZN 01510257 →Q7) Locate the approximate position of the transition state. Tag: Visual edit
20:4120:41, 22 May 2020 diff hist +1,922 MRD:ZN 01510257 →Q7) Locate the approximate position of the transition state. Tag: Visual edit
20:3620:36, 22 May 2020 diff hist +67 N File:ZN 01510257 Q7 Figure 4.png Internuclear distance vs time plot of final approximation of the TS current
20:3520:35, 22 May 2020 diff hist +56 N File:ZN 01510257 Q7 Figure 3.png Final approximation for the TS for a FH + H system by ZN current
20:2620:26, 22 May 2020 diff hist +55 N File:ZN 01510257 Q7 Figure 2.png Second approximation for the transition state position. current
20:2120:21, 22 May 2020 diff hist +60 N File:ZN 01510257 Q7 Figure 1.png Dynamic calculation of first approximation of the HF + H TS. current
20:1120:11, 22 May 2020 diff hist −1,061 MRD:ZN 01510257 No edit summary Tag: Visual edit
20:1020:10, 22 May 2020 diff hist +674 MRD:ZN 01510257 →EXERCISE 2: F - H - H system Tag: Visual edit
19:5319:53, 22 May 2020 diff hist 0 File:ZN 01510257 Q6 Figure 1.png Zn4318 uploaded a new version of File:ZN 01510257 Q6 Figure 1.png current
19:5319:53, 22 May 2020 diff hist +20 N File:ZN 01510257 Q6 Figure 1.png PES of FH + H system
19:4219:42, 22 May 2020 diff hist +2,187 MRD:ZN 01510257 →Q4) Complete the table above by adding the total energy, whether the trajectory is reactive or unreactive, and provide a plot of the trajectory and a small description for what happens along the trajectory. What can you conclude from the table? Tag: Visual edit
19:1219:12, 22 May 2020 diff hist +727 MRD:ZN 01510257 →Q4) Complete the table above by adding the total energy, whether the trajectory is reactive or unreactive, and provide a plot of the trajectory and a small description for what happens along the trajectory. What can you conclude from the table? Tag: Visual edit
18:5718:57, 22 May 2020 diff hist +559 MRD:ZN 01510257 →Q3) Comment on how the mep and the trajectory you just calculated differ. Tag: Visual edit
18:5218:52, 22 May 2020 diff hist +83 N File:ZN 01510257 Q3 Figure 5.png Dynamic calculated trajectory of the H2 + H system when displaced about r2 from TS. current
18:3118:31, 22 May 2020 diff hist +270 MRD:ZN 01510257 No edit summary Tag: Visual edit
18:3118:31, 22 May 2020 diff hist +81 N File:ZN 01510257 Q3 Figure 4.png Reversed dynamic calculation of the H2 + H system slightly displaced from the TS. current
18:3018:30, 22 May 2020 diff hist 0 File:ZN 01510257 Q4 Figure 4.png Zn4318 uploaded a new version of File:ZN 01510257 Q4 Figure 4.png current
18:2918:29, 22 May 2020 diff hist 0 File:ZN 01510257 Q4 Figure 4.png Zn4318 uploaded a new version of File:ZN 01510257 Q4 Figure 4.png
18:1918:19, 22 May 2020 diff hist +52 N File:ZN 01510257 Q3 Figure 3.png mep calculated energy vs time graph of H2+H reaction current

Retrieved from "https://chemwiki.ch.ic.ac.uk/wiki/Special:Contributions/Zn4318"