User contributions for Xc2017
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22 May 2019
- 15:2515:25, 22 May 2019 diff hist 0 MRD:xc2017 →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? Tag: Visual edit
- 15:2315:23, 22 May 2019 diff hist +114 MRD:xc2017 →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
- 15:1715:17, 22 May 2019 diff hist +410 MRD:xc2017 →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
- 15:0915:09, 22 May 2019 diff hist 0 MRD:xc2017 →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
- 15:0915:09, 22 May 2019 diff hist +77 MRD:xc2017 →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.
- 15:0815:08, 22 May 2019 diff hist 0 N File:MRD HHF HVE 1 0522.png No edit summary current
- 15:0815:08, 22 May 2019 diff hist +77 MRD:xc2017 →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.
- 15:0715:07, 22 May 2019 diff hist 0 N File:MRD HHF HTE 0522.png No edit summary current
- 14:5814:58, 22 May 2019 diff hist +322 MRD:xc2017 →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
- 13:5613:56, 22 May 2019 diff hist +32 MRD:xc2017 →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.
- 13:5513:55, 22 May 2019 diff hist +177 MRD:xc2017 →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.
- 13:5413:54, 22 May 2019 diff hist +327 MRD:xc2017 →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
- 13:4813:48, 22 May 2019 diff hist +189 MRD:xc2017 →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?
- 13:4613:46, 22 May 2019 diff hist −105 MRD:xc2017 →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
- 13:4413:44, 22 May 2019 diff hist +153 MRD:xc2017 →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.
- 13:4413:44, 22 May 2019 diff hist 0 N File:MRD FHH E1 0522.png No edit summary current
- 13:4213:42, 22 May 2019 diff hist 0 N File:MRD FHH R1 0522.png No edit summary current
- 13:4013:40, 22 May 2019 diff hist +293 MRD:xc2017 →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
- 13:2513:25, 22 May 2019 diff hist +167 MRD:xc2017 →Report the activation energy for both reactions.
- 13:2413:24, 22 May 2019 diff hist +67 MRD:xc2017 →Report the activation energy for both reactions.
- 13:2313:23, 22 May 2019 diff hist 0 N File:MRD HHF EA 1 0522.png No edit summary current
- 13:2213:22, 22 May 2019 diff hist +76 MRD:xc2017 →Report the activation energy for both reactions.
- 13:2013:20, 22 May 2019 diff hist +387 MRD:xc2017 →Report the activation energy for both reactions. Tag: Visual edit
- 13:0813:08, 22 May 2019 diff hist 0 N File:MRD FHH EA 0522.png No edit summary current
- 12:4512:45, 22 May 2019 diff hist +60 MRD:xc2017 →Locate the approximate position of the transition state.
- 12:4412:44, 22 May 2019 diff hist +33 MRD:xc2017 →Locate the approximate position of the transition state.
- 12:4412:44, 22 May 2019 diff hist +76 MRD:xc2017 →Locate the approximate position of the transition state.
- 12:4312:43, 22 May 2019 diff hist 0 N File:MRD FHH 0522.png No edit summary current
- 12:4012:40, 22 May 2019 diff hist +76 MRD:xc2017 →Locate the approximate position of the transition state.
- 12:3612:36, 22 May 2019 diff hist 0 N File:MRD HHF 0522 1.png No edit summary current
- 12:3612:36, 22 May 2019 diff hist +276 MRD:xc2017 →EXERCISE 2: F - H - H system Tag: Visual edit
- 12:2312:23, 22 May 2019 diff hist +69 MRD:xc2017 →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?
- 12:2212:22, 22 May 2019 diff hist +2 MRD:xc2017 →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?
- 12:2212:22, 22 May 2019 diff hist +238 MRD:xc2017 →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?
- 12:1912:19, 22 May 2019 diff hist +67 MRD:xc2017 →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?
- 12:1912:19, 22 May 2019 diff hist 0 N File:MRD HHF 0522.png No edit summary current
- 12:1712:17, 22 May 2019 diff hist 0 MRD:xc2017 →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? Tag: Visual edit
- 12:0412:04, 22 May 2019 diff hist +7 MRD:xc2017 →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?
- 12:0412:04, 22 May 2019 diff hist +237 MRD:xc2017 →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?
- 12:0112:01, 22 May 2019 diff hist +1 MRD:xc2017 →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?
- 12:0012:00, 22 May 2019 diff hist +6 MRD:xc2017 →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?
- 12:0012:00, 22 May 2019 diff hist +7 MRD:xc2017 →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?
- 11:5611:56, 22 May 2019 diff hist +25 MRD:xc2017 →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?
- 11:5511:55, 22 May 2019 diff hist −1 MRD:xc2017 →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?
- 11:5511:55, 22 May 2019 diff hist 0 N File:MDR FHH 0522.png No edit summary current
- 11:5411:54, 22 May 2019 diff hist +305 MRD:xc2017 No edit summary Tag: Visual edit
- 11:5011:50, 22 May 2019 diff hist +1 MRD:xc2017 →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?
- 11:3711:37, 22 May 2019 diff hist +231 MRD:xc2017 No edit summary
21 May 2019
- 16:3116:31, 21 May 2019 diff hist +151 MRD:xc2017 →Reference
- 16:3016:30, 21 May 2019 diff hist +12 MRD:xc2017 →State what are the main assumptions of Transition State Theory. Given the results you have obtained, how will Transition State Theory predictions for reaction rate values compare with experimental values?