Jump to content

User contributions for Xc2017

Results for Xc2017 talk block log uploads logs

A user with 576 edits. Account created on 26 February 2018.

13:2913:29, 21 May 2019 diff hist +2 MRD:xc2017 →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.
13:2913:29, 21 May 2019 diff hist +100 MRD:xc2017 →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.
13:2713:27, 21 May 2019 diff hist 0 N File:MRD XC 1.png No edit summary current
13:2213:22, 21 May 2019 diff hist +134 MRD:xc2017 → 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
13:0113:01, 21 May 2019 diff hist +17 MRD:xc2017 →1. On a potential energy surface diagram, how is the transition state mathematically defined? How can the transition state be identified, and how can it be distinguished from a local minimum of the potential energy surface? Tag: Visual edit
12:5612:56, 21 May 2019 diff hist +199 MRD:xc2017 →EXERCISE 1: H + H2 system
12:5512:55, 21 May 2019 diff hist +102 MRD:xc2017 No edit summary Tag: Visual edit
12:5112:51, 21 May 2019 diff hist +243 MRD:xc2017 →1.On a potential energy surface diagram, how is the transition state mathematically defined? How can the transition state be identified, and how can it be distinguished from a local minimum of the potential energy surface? Tag: Visual edit
12:1712:17, 21 May 2019 diff hist +310 MRD:xc2017 →1.On a potential energy surface diagram, how is the transition state mathematically defined? How can the transition state be identified, and how can it be distinguished from a local minimum of the potential energy surface?

14:5614:56, 20 May 2019 diff hist +4 MRD:xc2017 →1.On a potential energy surface diagram, how is the transition state mathematically defined? How can the transition state be identified, and how can it be distinguished from a local minimum of the potential energy surface?
14:5514:55, 20 May 2019 diff hist −43 MRD:xc2017 →1.Dynamics from the transition state region
14:5414:54, 20 May 2019 diff hist +38 MRD:xc2017 →EXERCISE 1: H + H2 system
14:5214:52, 20 May 2019 diff hist 0 MRD:xc2017 →EXERCISE 1: H + H2 system
14:5214:52, 20 May 2019 diff hist +11 MRD:xc2017 →EXERCISE 1: H + H2 system
14:4814:48, 20 May 2019 diff hist +232 MRD:xc2017 →EXERCISE 1: H + H2 system
14:2314:23, 20 May 2019 diff hist +33 N MRD:xc2017 Created page with "=== EXERCISE 1: H + H2 system ==="

14:3514:35, 10 May 2019 diff hist 0 Cxq2019 →MOs for [N(CH3)4]+ cation
14:3514:35, 10 May 2019 diff hist 0 N File:MO21 N(CH3)4 0510 1.PNG No edit summary current
14:3414:34, 10 May 2019 diff hist 0 N File:MO10 N(CH3)4 0510 1.PNG No edit summary current
14:3414:34, 10 May 2019 diff hist 0 N File:MO7 N(CH3)4 0510 1.PNG No edit summary current
14:2614:26, 10 May 2019 diff hist +13 Cxq2019 →MOs for [N(CH3)4]+ cation
14:2514:25, 10 May 2019 diff hist +268 Cxq2019 →MOs for [N(CH3)4]+ cation
14:2014:20, 10 May 2019 diff hist +108 Cxq2019 →MOs for [N(CH3)4]+ cation
14:1814:18, 10 May 2019 diff hist 0 N File:MO10 N(CH3)4 0510 CXQ.PNG No edit summary current
14:1214:12, 10 May 2019 diff hist +4 Cxq2019 →MOs for [N(CH3)4]+ cation
14:1214:12, 10 May 2019 diff hist 0 N File:MO21 N(CH3)4 0510 cxq.PNG No edit summary current
14:1014:10, 10 May 2019 diff hist 0 File:MO21 N(CH3)4 0510.PNG Xc2017 uploaded a new version of File:MO21 N(CH3)4 0510.PNG current
13:5713:57, 10 May 2019 diff hist −33 Cxq2019 →MOs for [N(CH3)4]+ cation
13:5713:57, 10 May 2019 diff hist +106 Cxq2019 →MOs for [N(CH3)4]+ cation
13:5413:54, 10 May 2019 diff hist +7 Cxq2019 →MOs for [N(CH3)4]+ cation
13:5313:53, 10 May 2019 diff hist +48 Cxq2019 →MOs for [N(CH3)4]+ cation
13:5013:50, 10 May 2019 diff hist 0 File:MO7 N(CH3)4 0510.PNG Xc2017 uploaded a new version of File:MO7 N(CH3)4 0510.PNG current
13:4613:46, 10 May 2019 diff hist +66 Cxq2019 →MOs for [N(CH3)4]+ cation
13:4613:46, 10 May 2019 diff hist 0 N File:MO21 N(CH3)4 0510.PNG No edit summary
13:2513:25, 10 May 2019 diff hist +67 Cxq2019 →MOs for [N(CH3)4]+ cation
13:2513:25, 10 May 2019 diff hist 0 N File:MO10 N(CH3)4 0510.PNG No edit summary current
13:1513:15, 10 May 2019 diff hist +61 Cxq2019 →MOs for [N(CH3)4]+ cation
13:1413:14, 10 May 2019 diff hist 0 N File:MO7 N(CH3)4 0510.PNG No edit summary
12:4412:44, 10 May 2019 diff hist +68 Cxq2019 →Validity of traditional description for [N(CH3)4]+ cation

15:5015:50, 9 May 2019 diff hist +328 Cxq2019 →Validity of traditional description for [N(CH3)4]+ cation
15:4415:44, 9 May 2019 diff hist 0 N File:BH3NH3 FREQ CXQ̠1.PNG No edit summary current
15:4415:44, 9 May 2019 diff hist +3 Cxq2019 →BH3NH3 molecules
15:4315:43, 9 May 2019 diff hist 0 File:BH3NH3 FREQ CXQ.PNG Xc2017 uploaded a new version of File:BH3NH3 FREQ CXQ.PNG current
15:4315:43, 9 May 2019 diff hist 0 File:BH3NH3 FREQ CXQ.PNG Xc2017 uploaded a new version of File:BH3NH3 FREQ CXQ.PNG
15:3715:37, 9 May 2019 diff hist −1 Cxq2019 →Validity of traditional description for [N(CH3)4]+ cation
15:3715:37, 9 May 2019 diff hist +375 Cxq2019 →Validity of traditional description for[N(CH3)4]+ cation
15:3115:31, 9 May 2019 diff hist +53 Cxq2019 →Validity of traditional description
15:2315:23, 9 May 2019 diff hist −5 Cxq2019 →Validity of this traditional description
15:2215:22, 9 May 2019 diff hist +52 Cxq2019 →Charge distribution of [N(CH3)4]+ cation and [P(CH3)4]+ cation
15:1915:19, 9 May 2019 diff hist 0 Cxq2019 →Charge distribution of [N(CH3)4]+ cation and [P(CH3)4]+ cation

Retrieved from "https://chemwiki.ch.ic.ac.uk/wiki/Special:Contributions/Xc2017"