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User contributions for Yt6718

Results for Yt6718 talk block log uploads logs

A user with 111 edits. Account created on 11 March 2019.

16:3916:39, 22 May 2020 diff hist 0 MRD:01541238 →Question 8. Report the activation energy for both reactions. Tag: Visual edit
14:5714:57, 22 May 2020 diff hist +667 MRD:01541238 →Question 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. Tag: Visual edit
14:3614:36, 22 May 2020 diff hist +16 MRD:01541238 No edit summary
14:3414:34, 22 May 2020 diff hist +2,525 MRD:01541238 →Question 9. 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
14:2514:25, 22 May 2020 diff hist 0 N File:18 01541238.png No edit summary current
14:0814:08, 22 May 2020 diff hist 0 N File:17 01541238.png No edit summary current
14:0214:02, 22 May 2020 diff hist 0 N File:16 01541238.png No edit summary current
13:5513:55, 22 May 2020 diff hist 0 N File:15 01541238.png No edit summary current
13:4913:49, 22 May 2020 diff hist 0 N File:14 01541238.png No edit summary current
12:0012:00, 22 May 2020 diff hist −9 MRD:01541238 →Question 7. Locate the approximate position of the transition state.
12:0012:00, 22 May 2020 diff hist +365 MRD:01541238 →Question 8. Report the activation energy for both reactions. Tag: Visual edit
11:4411:44, 22 May 2020 diff hist +686 MRD:01541238 →Question 3. Comment on how the mep and the trajectory you just calculated differ. Tag: Visual edit
11:4111:41, 22 May 2020 diff hist 0 N File:13 01541238.png No edit summary current
11:2011:20, 22 May 2020 diff hist +1 MRD:01541238 →Question 2. Report your best estimate of the transition state position (rts) and explain your reasoning illustrating it with a “Internuclear Distances vs Time” plot for a relevant trajectory. Tag: Visual edit
11:1911:19, 22 May 2020 diff hist −62 MRD:01541238 →The Molecular reaction dynamics computational lab report
11:1611:16, 22 May 2020 diff hist −11 MRD:01541238 No edit summary
11:1511:15, 22 May 2020 diff hist +1,216 MRD:01541238 →Question 5. Given the results you have obtained, how will Transition State Theory predictions for reaction rate values compare with experimental values? Tag: Visual edit
11:1211:12, 22 May 2020 diff hist 0 N File:12 01541238.png No edit summary current
10:0510:05, 22 May 2020 diff hist +2,579 MRD:01541238 →Question 3.Comment on how the mep and the trajectory you just calculated differ. Tag: Visual edit
08:2308:23, 22 May 2020 diff hist 0 N File:11 01541238.png No edit summary current
08:1908:19, 22 May 2020 diff hist 0 N File:10 2 01541238.png No edit summary current
08:1608:16, 22 May 2020 diff hist 0 N File:10 01541238.png No edit summary current
08:1408:14, 22 May 2020 diff hist 0 N File:9 01541238.png No edit summary current
08:1208:12, 22 May 2020 diff hist 0 N File:8 01541238.png No edit summary current
08:0908:09, 22 May 2020 diff hist 0 N File:7 01541238.png No edit summary current
07:3007:30, 22 May 2020 diff hist +331 MRD:01541238 →Question 3.Comment on how the mep and the trajectory you just calculated differ. Tag: Visual edit
07:2807:28, 22 May 2020 diff hist 0 N File:6 01541238.png No edit summary current
07:2507:25, 22 May 2020 diff hist 0 N File:4 2 01541238.png No edit summary current
07:2407:24, 22 May 2020 diff hist 0 N File:4 01541238.png No edit summary current
07:2107:21, 22 May 2020 diff hist 0 N File:5 01541238.png No edit summary current
07:1707:17, 22 May 2020 diff hist 0 N File:4 0154.png No edit summary current
07:0707:07, 22 May 2020 diff hist +1,583 MRD:01541238 No edit summary Tag: Visual edit
06:3906:39, 22 May 2020 diff hist +194 MRD:01541238 →The Molecular reaction dynamics computational lab report Tag: Visual edit

15:0415:04, 21 May 2020 diff hist +367 m MRD:01541238 No edit summary Tag: Visual edit
14:5114:51, 21 May 2020 diff hist 0 File:2.png Yt6718 uploaded a new version of File:2.png current
14:4514:45, 21 May 2020 diff hist 0 File:1.png Yt6718 uploaded a new version of File:1.png current
14:4214:42, 21 May 2020 diff hist +39 MRD:01541238 →The Molecular reaction dynamics computational lab report Tag: Visual edit
10:4510:45, 21 May 2020 diff hist +60 N MRD:01541238 Created page with "= The Molecular reaction dynamics computational lab report =" Tag: Visual edit

19:1419:14, 14 March 2019 diff hist +1,840 Yt6718 →CH4 optimisation
19:0619:06, 14 March 2019 diff hist 0 N File:01541238-39.png No edit summary current
19:0519:05, 14 March 2019 diff hist 0 N File:01541238-38.png No edit summary current
19:0519:05, 14 March 2019 diff hist 0 N File:01541238-37.png No edit summary current
19:0519:05, 14 March 2019 diff hist 0 N File:01541238-36.png No edit summary current
19:0519:05, 14 March 2019 diff hist 0 N File:01541238-35.png No edit summary current
19:0519:05, 14 March 2019 diff hist 0 N File:01541238-34.png No edit summary current
18:5018:50, 14 March 2019 diff hist 0 N File:01541238-33.png No edit summary current
18:5018:50, 14 March 2019 diff hist 0 N File:01541238-32.png No edit summary current
18:5018:50, 14 March 2019 diff hist 0 N File:01541238-31.png No edit summary current
18:4918:49, 14 March 2019 diff hist 0 N File:01541238-30.png No edit summary current
18:4918:49, 14 March 2019 diff hist 0 N File:01541238-29.png No edit summary current

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