User contributions for Yj6018

6 May 2020

• 04:1004:10, 6 May 2020 diff hist +911 MRD:yingtingjiaYJ6018 →Prediction of rate of reaction using Transition State Theory Tag: Visual edit
• 03:3603:36, 6 May 2020 diff hist +451 MRD:yingtingjiaYJ6018 →Transition state Tag: Visual edit

5 May 2020

• 16:3716:37, 5 May 2020 diff hist +2,641 MRD:yingtingjiaYJ6018 No edit summary Tag: Visual edit
• 14:2114:21, 5 May 2020 diff hist +1,403 MRD:yingtingjiaYJ6018 →Reactive and unreactive trajectories Tag: Visual edit
• 13:3013:30, 5 May 2020 diff hist +637 MRD:yingtingjiaYJ6018 →Reactive and unreactive trajectories Tag: Visual edit
• 12:4612:46, 5 May 2020 diff hist +745 MRD:yingtingjiaYJ6018 →Trajectory in contour plot Tag: Visual edit
• 11:5311:53, 5 May 2020 diff hist +419 MRD:yingtingjiaYJ6018 →Define transition state in potential energy surface Tag: Visual edit
• 11:1911:19, 5 May 2020 diff hist +465 MRD:yingtingjiaYJ6018 →Reactive and unreactive trajectories Tag: Visual edit
• 05:3505:35, 5 May 2020 diff hist +2 MRD:yingtingjiaYJ6018 →Internuclear distance vs Time plot Tag: Visual edit
• 05:3405:34, 5 May 2020 diff hist −4 MRD:yingtingjiaYJ6018 →Comparison of MEP and Dynamics Tag: Visual edit
• 05:3405:34, 5 May 2020 diff hist +1,403 MRD:yingtingjiaYJ6018 →Internuclear distance vs Time plot Tag: Visual edit

4 May 2020

• 18:0218:02, 4 May 2020 diff hist +727 MRD:yingtingjiaYJ6018 →Comparison of MEP and Dynamics Tag: Visual edit
• 17:2817:28, 4 May 2020 diff hist +699 MRD:yingtingjiaYJ6018 No edit summary Tag: Visual edit
• 16:5816:58, 4 May 2020 diff hist +136 MRD:yingtingjiaYJ6018 →Define transition state in potential energy surface: Tag: Visual edit
• 16:4616:46, 4 May 2020 diff hist +271 MRD:yingtingjiaYJ6018 →Locating transition state position: Tag: Visual edit
• 16:2916:29, 4 May 2020 diff hist −8 MRD:yingtingjiaYJ6018 →Conditions transition state should satisfy: Tag: Visual edit
• 16:2816:28, 4 May 2020 diff hist +682 MRD:yingtingjiaYJ6018 →Question 1 Tag: Visual edit
• 15:5015:50, 4 May 2020 diff hist +2 MRD:yingtingjiaYJ6018 No edit summary Tag: Visual edit
• 14:2514:25, 4 May 2020 diff hist +639 N MRD:yingtingjiaYJ6018 Created page with "==Transition State== ===Question 1=== Transition state is defined as the saddle point in the potential energy surface diagram where the curvature is zero. So the first derivat..."

15 March 2019

• 15:1815:18, 15 March 2019 diff hist +13 Rep:Mod:01509348 →molecular orbitals of CO
• 15:1615:16, 15 March 2019 diff hist +1 Rep:Mod:01509348 →molecular orbitals of CO
• 15:1515:15, 15 March 2019 diff hist 0 Rep:Mod:01509348 →molecular orbitals of CO
• 15:1415:14, 15 March 2019 diff hist +2 Rep:Mod:01509348 →Energy of reaction involves CH4
• 15:1315:13, 15 March 2019 diff hist +1 Rep:Mod:01509348 →Charge of atoms in CH4
• 15:1315:13, 15 March 2019 diff hist +2 Rep:Mod:01509348 →H2O
• 15:1315:13, 15 March 2019 diff hist −8 Rep:Mod:01509348 →Energy of reaction involves CH4
• 15:1215:12, 15 March 2019 diff hist −4 Rep:Mod:01509348 →CO2
• 15:0915:09, 15 March 2019 diff hist +1 Rep:Mod:01509348 →Energy of reaction involves CH4
• 15:0815:08, 15 March 2019 diff hist −9 Rep:Mod:01509348 →molecular orbitals of CO
• 15:0715:07, 15 March 2019 diff hist +1 Rep:Mod:01509348 →Energy of reaction involves CO
• 15:0715:07, 15 March 2019 diff hist +1 Rep:Mod:01509348 →Energy of reaction involves CO
• 15:0315:03, 15 March 2019 diff hist −2 Rep:Mod:01509348 →Energy of reaction involves CH4
• 15:0015:00, 15 March 2019 diff hist +27 Rep:Mod:01509348 →Energy of reaction involves CH4
• 14:5514:55, 15 March 2019 diff hist −1 Rep:Mod:01509348 →molecular orbitals of CO=
• 14:5514:55, 15 March 2019 diff hist 0 Rep:Mod:01509348 →=molecular orbitals of CO
• 14:5514:55, 15 March 2019 diff hist +1 Rep:Mod:01509348 →Energy of reaction involves CH4
• 14:5214:52, 15 March 2019 diff hist +588 Rep:Mod:01509348 No edit summary
• 14:3714:37, 15 March 2019 diff hist +40 Rep:Mod:01509348 No edit summary
• 14:3614:36, 15 March 2019 diff hist 0 N File:Yingting JiaCH4 VIBRATIONS.PNG No edit summary current
• 14:3414:34, 15 March 2019 diff hist +120 Rep:Mod:01509348 No edit summary
• 14:3214:32, 15 March 2019 diff hist +18 Rep:Mod:01509348 →item table
• 14:3014:30, 15 March 2019 diff hist +273 Rep:Mod:01509348 No edit summary
• 14:2614:26, 15 March 2019 diff hist −1 Rep:Mod:01509348 →item table
• 14:2514:25, 15 March 2019 diff hist −12 Rep:Mod:01509348 →item table
• 14:2514:25, 15 March 2019 diff hist 0 N File:YINGTING JIA-CHE FINAL.LOG No edit summary current
• 14:2414:24, 15 March 2019 diff hist +309 Rep:Mod:01509348 No edit summary
• 14:2414:24, 15 March 2019 diff hist +2 Rep:Mod:01509348 →item table
• 14:2314:23, 15 March 2019 diff hist +3 Rep:Mod:01509348 No edit summary
• 14:2214:22, 15 March 2019 diff hist −6 Rep:Mod:01509348 →item table
• 14:1814:18, 15 March 2019 diff hist +1 Rep:Mod:01509348 →NH3 optimisation