User contributions for Us1417

23 May 2019

• 13:1413:14, 23 May 2019 diff hist 0 File:Hhf.PNG Us1417 uploaded a new version of File:Hhf.PNG current
• 13:1413:14, 23 May 2019 diff hist +107 MRD:PhyPro /* 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? Locate the approximate posit...
• 13:0513:05, 23 May 2019 diff hist +68 MRD:PhyPro →EXERCISE 2: F - H - H system
• 13:0213:02, 23 May 2019 diff hist −1 MRD:PhyPro →EXERCISE 2: F - H - H system
• 13:0113:01, 23 May 2019 diff hist +18 MRD:PhyPro →EXERCISE 2: F - H - H system
• 13:0013:00, 23 May 2019 diff hist 0 N File:Hhf.PNG No edit summary
• 13:0013:00, 23 May 2019 diff hist +761 MRD:PhyPro →EXERCISE 2: F - H - H system
• 12:2812:28, 23 May 2019 diff hist 0 MRD:PhyPro →EXERCISE 2: F - H - H system
• 12:2812:28, 23 May 2019 diff hist −1 MRD:PhyPro →EXERCISE 2: F - H - H system
• 12:2812:28, 23 May 2019 diff hist +285 MRD:PhyPro →EXERCISE 2: F - H - H system
• 12:2712:27, 23 May 2019 diff hist +170 MRD:PhyPro →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 valuesʔ

22 May 2019

• 20:3920:39, 22 May 2019 diff hist +2,081 MRD:PhyPro →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 valuesʔ
• 20:1620:16, 22 May 2019 diff hist +338 MRD:PhyPro →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?
• 20:1320:13, 22 May 2019 diff hist +756 MRD:PhyPro →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?
• 20:0520:05, 22 May 2019 diff hist +640 MRD:PhyPro →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?
• 19:5819:58, 22 May 2019 diff hist +105 MRD:PhyPro →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?
• 19:5619:56, 22 May 2019 diff hist +435 MRD:PhyPro →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?

21 May 2019

• 15:5015:50, 21 May 2019 diff hist 0 MRD:PhyPro →Exercise 1ː H + H2 system
• 15:5015:50, 21 May 2019 diff hist +34 MRD:PhyPro →Molecular Reaction Dynamicsː Computational Lab
• 15:4915:49, 21 May 2019 diff hist +213 MRD:PhyPro →Molecular Reaction Dynamicsː Computational Lab
• 15:4715:47, 21 May 2019 diff hist +22 MRD:PhyPro →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?
• 15:4615:46, 21 May 2019 diff hist +3 MRD:PhyPro →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?
• 15:4515:45, 21 May 2019 diff hist 0 File:Traj5.PNG Us1417 uploaded a new version of File:Traj5.PNG current
• 15:4515:45, 21 May 2019 diff hist 0 File:Traj4.PNG Us1417 uploaded a new version of File:Traj4.PNG current
• 15:4515:45, 21 May 2019 diff hist 0 File:Traj3.PNG Us1417 uploaded a new version of File:Traj3.PNG current
• 15:4515:45, 21 May 2019 diff hist 0 File:Traj2.PNG Us1417 uploaded a new version of File:Traj2.PNG current
• 15:4515:45, 21 May 2019 diff hist −17 MRD:PhyPro →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?
• 15:4415:44, 21 May 2019 diff hist +6 MRD:PhyPro →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?
• 15:4415:44, 21 May 2019 diff hist +2 MRD:PhyPro →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?
• 15:4315:43, 21 May 2019 diff hist +15 MRD:PhyPro →Molecular Reaction Dynamicsː Computational Lab
• 15:4315:43, 21 May 2019 diff hist 0 File:Traj1.PNG Us1417 uploaded a new version of File:Traj1.PNG current
• 15:3815:38, 21 May 2019 diff hist +1 MRD:PhyPro →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?
• 15:3715:37, 21 May 2019 diff hist +1 MRD:PhyPro →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?
• 15:3715:37, 21 May 2019 diff hist +19 MRD:PhyPro →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?
• 15:3515:35, 21 May 2019 diff hist 0 MRD:PhyPro →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?
• 15:3515:35, 21 May 2019 diff hist −21 MRD:PhyPro →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?
• 15:3415:34, 21 May 2019 diff hist −58 MRD:PhyPro →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?
• 15:3315:33, 21 May 2019 diff hist +58 MRD:PhyPro →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?
• 15:3315:33, 21 May 2019 diff hist −1 MRD:PhyPro →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?
• 15:3315:33, 21 May 2019 diff hist +13 MRD:PhyPro →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?
• 15:3215:32, 21 May 2019 diff hist +14 MRD:PhyPro →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?
• 15:3115:31, 21 May 2019 diff hist −36 MRD:PhyPro →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?
• 15:3115:31, 21 May 2019 diff hist +5 MRD:PhyPro →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?
• 15:3015:30, 21 May 2019 diff hist +1 MRD:PhyPro →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?
• 15:3015:30, 21 May 2019 diff hist +12 MRD:PhyPro →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?
• 15:2915:29, 21 May 2019 diff hist −15 MRD:PhyPro →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?
• 15:2915:29, 21 May 2019 diff hist 0 MRD:PhyPro →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?
• 15:2915:29, 21 May 2019 diff hist −15 MRD:PhyPro →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?
• 15:2815:28, 21 May 2019 diff hist −11 MRD:PhyPro →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?
• 15:2815:28, 21 May 2019 diff hist +7 MRD:PhyPro →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?