User contributions for Us1417

21 May 2019

• 15:2715:27, 21 May 2019 diff hist +4 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?
• 15:2715:27, 21 May 2019 diff hist −37 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?
• 15:2615:26, 21 May 2019 diff hist +4 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?
• 15:2615:26, 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?
• 15:2615:26, 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?
• 15:2515:25, 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?
• 15:2515:25, 21 May 2019 diff hist +49 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?
• 15:2415:24, 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?
• 15:2315:23, 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?
• 15:2315:23, 21 May 2019 diff hist +389 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?
• 15:1715:17, 21 May 2019 diff hist +248 MRD:PhyPro →Molecular Reaction Dynamicsː Computational Lab
• 15:1615:16, 21 May 2019 diff hist +458 MRD:PhyPro →Comment on how the mep and the trajectory you just calculated differ.
• 15:0615:06, 21 May 2019 diff hist +137 MRD:PhyPro →Comment on how the mep and the trajectory you just calculated differ.
• 15:0415:04, 21 May 2019 diff hist +2 MRD:PhyPro →Comment on how the mep and the trajectory you just calculated differ.
• 15:0415:04, 21 May 2019 diff hist 0 File:Mep1.PNG Us1417 uploaded a new version of File:Mep1.PNG
• 15:0415:04, 21 May 2019 diff hist 0 N File:Dyna1.PNG No edit summary current
• 14:5814:58, 21 May 2019 diff hist +37 MRD:PhyPro →Comment on how the mep and the trajectory you just calculated differ.
• 14:5814:58, 21 May 2019 diff hist 0 N File:Dyna.PNG No edit summary current
• 14:5714:57, 21 May 2019 diff hist 0 File:Mep.PNG Us1417 uploaded a new version of File:Mep.PNG current
• 14:5014:50, 21 May 2019 diff hist +77 MRD:PhyPro →Exercise 1ː H + H2 system
• 14:4914:49, 21 May 2019 diff hist +110 MRD:PhyPro →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.
• 14:4814:48, 21 May 2019 diff hist +117 MRD:PhyPro →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.
• 14:4514:45, 21 May 2019 diff hist +160 MRD:PhyPro →Exercise 1ː H + H2 system
• 14:4114:41, 21 May 2019 diff hist 0 N File:Distance.PNG No edit summary current
• 14:4014:40, 21 May 2019 diff hist +161 MRD:PhyPro →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.
• 14:3714:37, 21 May 2019 diff hist +1 MRD:PhyPro →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.
• 14:3714:37, 21 May 2019 diff hist 0 N File:11.PNG No edit summary current
• 14:3614:36, 21 May 2019 diff hist 0 MRD:PhyPro →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.
• 14:3614:36, 21 May 2019 diff hist −1 MRD:PhyPro →Molecular Reaction Dynamicsː Computational Lab
• 14:3514:35, 21 May 2019 diff hist 0 File:1.PNG Us1417 uploaded a new version of File:1.PNG current
• 14:3514:35, 21 May 2019 diff hist 0 MRD:PhyPro →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.
• 14:3514:35, 21 May 2019 diff hist 0 MRD:PhyPro →Exercise 1ː H + H2 system
• 14:3514:35, 21 May 2019 diff hist +157 MRD:PhyPro →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.
• 14:3314:33, 21 May 2019 diff hist −2 MRD:PhyPro →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‖
• 14:3314:33, 21 May 2019 diff hist +402 MRD:PhyPro →Exercise 1ː H + H2 system
• 14:2714:27, 21 May 2019 diff hist +36 MRD:PhyPro →Exercise 1ː H + H2 system
• 14:2314:23, 21 May 2019 diff hist +134 MRD:PhyPro →Exercise 1ː H + H2 system
• 14:2014:20, 21 May 2019 diff hist +34 MRD:PhyPro →Exercise 1ː H + H2 system
• 14:1814:18, 21 May 2019 diff hist +328 MRD:PhyPro →Exercise 1ː H + H2 system
• 14:1314:13, 21 May 2019 diff hist +43 MRD:PhyPro →Exercise 1ː H + H2 system
• 14:1314:13, 21 May 2019 diff hist −6 MRD:PhyPro →Exercise 1ː H + H2 system
• 14:1214:12, 21 May 2019 diff hist 0 N File:Blue.PNG No edit summary current
• 14:1214:12, 21 May 2019 diff hist 0 N File:Red.PNG No edit summary current
• 14:1214:12, 21 May 2019 diff hist +324 MRD:PhyPro →Exercise 1ː H + H2 system
• 13:2913:29, 21 May 2019 diff hist +100 MRD:PhyPro →Exercise 1ː H + H2 system
• 13:2713:27, 21 May 2019 diff hist +217 MRD:PhyPro →Molecular Reaction Dynamicsː Computational Lab
• 13:2413:24, 21 May 2019 diff hist +70 MRD:PhyPro →Exercise 1ː H + H2 system
• 13:0613:06, 21 May 2019 diff hist +24 MRD:PhyPro →Exercise 1ː H + H2 system
• 13:0513:05, 21 May 2019 diff hist 0 File:Potential.PNG Us1417 uploaded a new version of File:Potential.PNG current
• 13:0513:05, 21 May 2019 diff hist 0 MRD:PhyPro →Exercise 1ː H + H2 system