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22 May 2020
- 21:3521:35, 22 May 2020 diff hist +1 MRD:hs4018 mrd →References
- 21:3521:35, 22 May 2020 diff hist −2 MRD:hs4018 mrd →References
- 21:3521:35, 22 May 2020 diff hist +18 MRD:hs4018 mrd →Given the results you have obtained, how will Transition State Theory predictions for reaction rate values compare with experimental values?
- 21:3421:34, 22 May 2020 diff hist +20 MRD:hs4018 mrd →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.
- 21:3421:34, 22 May 2020 diff hist +158 MRD:hs4018 mrd →References
- 21:3321:33, 22 May 2020 diff hist +322 MRD:hs4018 mrd →Given the results you have obtained, how will Transition State Theory predictions for reaction rate values compare with experimental values?
- 21:3021:30, 22 May 2020 diff hist −12 MRD:hs4018 mrd →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?
- 21:2921:29, 22 May 2020 diff hist +25 MRD:hs4018 mrd →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?
- 21:2921:29, 22 May 2020 diff hist +5 MRD:hs4018 mrd →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?
- 21:2821:28, 22 May 2020 diff hist +26 MRD:hs4018 mrd →References
- 21:2621:26, 22 May 2020 diff hist +231 MRD:hs4018 mrd →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.
- 21:2221:22, 22 May 2020 diff hist +361 MRD:hs4018 mrd →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.
- 21:1021:10, 22 May 2020 diff hist +44 MRD:hs4018 mrd /* Identify a set of initial conditions that results in a reactive trajectory for the F + H2, and look at the “Animation” and “Momenta vs Time”. In light of the fact that energy is conserved, discuss the mechanism of release of the reaction ene...
- 21:0821:08, 22 May 2020 diff hist +5 MRD:hs4018 mrd /* Identify a set of initial conditions that results in a reactive trajectory for the F + H2, and look at the “Animation” and “Momenta vs Time”. In light of the fact that energy is conserved, discuss the mechanism of release of the reaction ene...
- 21:0721:07, 22 May 2020 diff hist +212 MRD:hs4018 mrd No edit summary
- 21:0621:06, 22 May 2020 diff hist 0 N File:Screenshot 2020-05-22 at 22.05.03.png No edit summary current
- 21:0521:05, 22 May 2020 diff hist 0 N File:Screenshot 2020-05-22 at 22.05.14.png No edit summary current
- 21:0221:02, 22 May 2020 diff hist +207 MRD:hs4018 mrd No edit summary
- 21:0121:01, 22 May 2020 diff hist +1,400 MRD:hs4018 mrd →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.
- 16:5816:58, 22 May 2020 diff hist +53 MRD:hs4018 mrd →Locate the approximate position of the transition state and the activation energies.
- 16:5616:56, 22 May 2020 diff hist 0 File:Contour Plot of H2 F TS.png Hs4018 uploaded a new version of File:Contour Plot of H2 F TS.png current
- 16:5516:55, 22 May 2020 diff hist +271 MRD:hs4018 mrd →Locate the approximate position of the transition state and the activation energies.
- 16:5416:54, 22 May 2020 diff hist 0 N File:Contour Plot of HF H TS 00961729.png No edit summary current
- 16:5316:53, 22 May 2020 diff hist 0 N File:Contour Plot of H2 F TS.png No edit summary
- 16:5116:51, 22 May 2020 diff hist +14 MRD:hs4018 mrd →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.
- 16:5116:51, 22 May 2020 diff hist +4 MRD:hs4018 mrd →Locate the approximate position of the transition state and the activation energies.
- 16:5116:51, 22 May 2020 diff hist +5 MRD:hs4018 mrd No edit summary
- 16:5116:51, 22 May 2020 diff hist −2 MRD:hs4018 mrd →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?
- 16:5016:50, 22 May 2020 diff hist −7 MRD:hs4018 mrd →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?
- 16:5016:50, 22 May 2020 diff hist −14 MRD:hs4018 mrd →Locate the approximate position of the transition state and the activation energies.
- 16:5016:50, 22 May 2020 diff hist +4 MRD:hs4018 mrd →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.
- 16:5016:50, 22 May 2020 diff hist +3 MRD:hs4018 mrd →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.
- 16:5016:50, 22 May 2020 diff hist +12 MRD:hs4018 mrd →Molecular Reaction Dynamics: Applications to Triatomic systems
- 16:4916:49, 22 May 2020 diff hist +163 MRD:hs4018 mrd No edit summary
- 16:4816:48, 22 May 2020 diff hist +68 MRD:hs4018 mrd →Locate the approximate position of the transition state and the activation energies.
- 16:4816:48, 22 May 2020 diff hist +116 MRD:hs4018 mrd No edit summary
- 16:4716:47, 22 May 2020 diff hist 0 N File:Screenshot 2020-05-22 at 17.46.28.png No edit summary current
- 16:4516:45, 22 May 2020 diff hist +71 MRD:hs4018 mrd →Locate the approximate position of the transition state and the activation energies.
- 16:2516:25, 22 May 2020 diff hist +706 MRD:hs4018 mrd →Locate the approximate position of the transition state.
- 15:3915:39, 22 May 2020 diff hist −2 MRD:hs4018 mrd →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?
- 15:3815:38, 22 May 2020 diff hist 0 N File:HF-H ENDO 00961729.png No edit summary current
- 15:3815:38, 22 May 2020 diff hist 0 N File:H2-F Exo 00961729.png No edit summary current
- 11:1511:15, 22 May 2020 diff hist +11 MRD:hs4018 mrd →Exercise 2: F - H - H system
- 11:1511:15, 22 May 2020 diff hist +18 MRD:hs4018 mrd →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?
- 11:1411:14, 22 May 2020 diff hist +953 MRD:hs4018 mrd →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?
- 11:0611:06, 22 May 2020 diff hist −21 MRD:hs4018 mrd →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?
- 11:0411:04, 22 May 2020 diff hist +31 MRD:hs4018 mrd →Exercise 2: F - H - H system
- 11:0411:04, 22 May 2020 diff hist +69 MRD:hs4018 mrd →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?
- 11:0411:04, 22 May 2020 diff hist +68 MRD:hs4018 mrd No edit summary
- 11:0311:03, 22 May 2020 diff hist +297 MRD:hs4018 mrd →Exercise 2: F - H - H system