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User contributions for Msk315

Results for Msk315 talk block log uploads logs

A user with 253 edits. Account created on 22 February 2016.

22:2122:21, 6 March 2018 diff hist 0 N File:Pressure time.png No edit summary
22:2022:20, 6 March 2018 diff hist 0 N File:Totalenergy time.png No edit summary
22:0822:08, 6 March 2018 diff hist +404 User:Msk315 No edit summary

23:2823:28, 5 March 2018 diff hist −54 User:Msk315 →TASK: Estimate the number of water molecules in 1ml of water under standard conditions.
23:2223:22, 5 March 2018 diff hist 0 User:Msk315 →TASK: Estimate the number of water molecules in 1ml of water under standard conditions.
23:0823:08, 5 March 2018 diff hist +237 User:Msk315 →TASK: For a single Lennard-Jones interaction,
22:5222:52, 5 March 2018 diff hist +2,764 User:Msk315 No edit summary
22:3022:30, 5 March 2018 diff hist +1,636 User:Msk315 No edit summary
21:4521:45, 5 March 2018 diff hist −175 User:Msk315 →TASK: For a single Lennard-Jones interaction,
21:4421:44, 5 March 2018 diff hist +184 User:Msk315 →Tasks / Lab book
21:2821:28, 5 March 2018 diff hist −360 User:Msk315 →TASK: Open the file HO.xls.
21:2421:24, 5 March 2018 diff hist −207 User:Msk315 No edit summary
21:2221:22, 5 March 2018 diff hist +6,737 N User:Msk315 Created page with "== Report == === Abstract === Molecular dynamics simulation === References === == Tasks / Lab book == ==== '''<big>TASK</big>: Open the file HO.xls. ''' ==== '''In it, the..."

16:4316:43, 5 May 2017 diff hist +1,152 MRD:msk315 →Exercise 2: F - H - H system
15:5715:57, 5 May 2017 diff hist −165 MRD:msk315 →Report the activation energy for both reactions

22:5022:50, 4 May 2017 diff hist +268 MRD:msk315 →Exercise 2: F - H - H system
19:5919:59, 4 May 2017 diff hist +296 MRD:msk315 →Locate the approximate position of the transition state
19:4519:45, 4 May 2017 diff hist 0 N File:Capturemsk315.PNG No edit summary current
19:4419:44, 4 May 2017 diff hist −9 MRD:msk315 →Locate the approximate position of the transition state
19:2819:28, 4 May 2017 diff hist −14 MRD:msk315 →Report your best estimate of the transition state position (rts) and explain your reasoning illustrating it with a “Internuclear Distances vs Time” screenshot for a relevant trajectory.
19:2619:26, 4 May 2017 diff hist −16 MRD:msk315 →Report your best estimate of the transition state position (rts) and explain your reasoning illustrating it with a “Internuclear Distances vs Time” screenshot for a relevant trajectory.
19:2319:23, 4 May 2017 diff hist 0 N File:Hydrogenfluorinemsk315.PNG No edit summary current
19:2119:21, 4 May 2017 diff hist +14 MRD:msk315 →Locate the approximate position of the transition state
19:1919:19, 4 May 2017 diff hist +250 MRD:msk315 →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?
19:1319:13, 4 May 2017 diff hist +6 MRD:msk315 →Exercise 2: F - H - H system
19:1319:13, 4 May 2017 diff hist +55 MRD:msk315 →Exercise 2: F - H - H system
19:1119:11, 4 May 2017 diff hist +132 MRD:msk315 →Exercise 2: F - H - H system
17:3817:38, 4 May 2017 diff hist +1,103 MRD:msk315 →Exercise 1: H + H2 system
15:4515:45, 4 May 2017 diff hist 0 MRD:msk315 →Exercise 1: H + H2 system
15:4415:44, 4 May 2017 diff hist 0 MRD:msk315 →Exercise 1: H + H2 system
15:4015:40, 4 May 2017 diff hist 0 N File:2.5and5msk315.PNG No edit summary current
15:4015:40, 4 May 2017 diff hist 0 N File:2.5and5.2msk315.PNG No edit summary current
15:4015:40, 4 May 2017 diff hist 0 N File:1.25and2.5msk315.PNG No edit summary current
15:3915:39, 4 May 2017 diff hist 0 N File:1.5and2.5msk315.PNG No edit summary current
15:3915:39, 4 May 2017 diff hist 0 File:1.5and2.0msk315.PNG Msk315 uploaded a new version of File:1.5and2.0msk315.PNG current
15:3915:39, 4 May 2017 diff hist 0 N File:1.5and2.0msk315.PNG No edit summary
15:3515:35, 4 May 2017 diff hist +1,159 MRD:msk315 →Exercise 1: H + H2 system
15:1115:11, 4 May 2017 diff hist +543 MRD:msk315 →Exercise 1: H + H2 system
14:2214:22, 4 May 2017 diff hist 0 N File:Screenshot1msk315.PNG No edit summary current
14:2214:22, 4 May 2017 diff hist +727 MRD:msk315 →Exercise 1: H + H2 system
14:1214:12, 4 May 2017 diff hist +697 N MRD:msk315 Created page with "== Exercise 1: H + H<sub>2</sub> system == ''What value does the total gradient of the potential energy surface have at a minimum and at a transition structure? Briefly expl..."

17:0917:09, 26 February 2016 diff hist +165 Rep:Mod:Ekang912 →Charge Analysis
17:0617:06, 26 February 2016 diff hist −1 Rep:Mod:Ekang912 →My own choice of small molecule 1: Water, H2O
17:0117:01, 26 February 2016 diff hist +826 Rep:Mod:Ekang912 No edit summary
16:4716:47, 26 February 2016 diff hist +175 Rep:Mod:Ekang912 →Vibration Modes
16:4716:47, 26 February 2016 diff hist −11 Rep:Mod:Ekang912 →Vibration Modes
16:4516:45, 26 February 2016 diff hist 0 Rep:Mod:Ekang912 →Vibration Modes
16:4416:44, 26 February 2016 diff hist +245 Rep:Mod:Ekang912 No edit summary
16:3516:35, 26 February 2016 diff hist +207 Rep:Mod:Ekang912 No edit summary
16:2316:23, 26 February 2016 diff hist +174 Rep:Mod:Ekang912 No edit summary

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