User contributions for Hnt14

8 May 2017

• 12:1312:13, 8 May 2017 diff hist +35 MRD:hnt14 →Molecule Reaction Dynamics
• 12:0512:05, 8 May 2017 diff hist 0 N File:Capture1 hnt14.PNG No edit summary current
• 11:2911:29, 8 May 2017 diff hist +271 MRD:hnt14 →Molecule Reaction Dynamics

7 May 2017

• 21:3421:34, 7 May 2017 diff hist +239 MRD:hnt14 →Molecule Reaction Dynamics
• 21:2221:22, 7 May 2017 diff hist +751 MRD:hnt14 →Molecule Reaction Dynamics
• 21:2021:20, 7 May 2017 diff hist 0 N File:Capture5 hnt14.PNG No edit summary current
• 21:1521:15, 7 May 2017 diff hist 0 N File:Capture4 hnt14.PNG No edit summary current
• 21:0121:01, 7 May 2017 diff hist 0 N File:Capture3 hnt14.PNG No edit summary current
• 20:5820:58, 7 May 2017 diff hist 0 N File:Capture2 hnt14.PNG No edit summary current
• 20:4220:42, 7 May 2017 diff hist +500 MRD:hnt14 →Molecule Reaction Dynamics
• 20:1820:18, 7 May 2017 diff hist 0 File:Capture hnt14.PNG Hnt14 uploaded a new version of File:Capture hnt14.PNG current
• 20:1020:10, 7 May 2017 diff hist 0 N File:Capture hnt14.PNG No edit summary
• 20:0820:08, 7 May 2017 diff hist +577 MRD:hnt14 →Molecule Reaction Dynamics
• 19:2019:20, 7 May 2017 diff hist +636 N MRD:hnt14 Created page with "==Molecule Reaction Dynamics== ===Exercise 1: H + H(2) System=== '''Question 1:'''What value does the total gradient of the potential energy surface have at a minimum and at a..."

26 February 2016

• 17:4717:47, 26 February 2016 diff hist +205 ModXYZ1234 No edit summary current
• 17:4517:45, 26 February 2016 diff hist −21 ModXYZ1234 No edit summary
• 17:4417:44, 26 February 2016 diff hist +1,924 ModXYZ1234 No edit summary Tag: Visual edit
• 16:4116:41, 26 February 2016 diff hist 0 N File:Mo5hania.png No edit summary current
• 16:4116:41, 26 February 2016 diff hist 0 N File:Mo4hania.png No edit summary current
• 16:4016:40, 26 February 2016 diff hist 0 N File:Mo3hania.png No edit summary current
• 16:4016:40, 26 February 2016 diff hist 0 N File:Mo2hania.png No edit summary current
• 16:4016:40, 26 February 2016 diff hist 0 N File:Mo1hania.png No edit summary current
• 16:1516:15, 26 February 2016 diff hist +977 ModXYZ1234 No edit summary Tag: Visual edit: Switched
• 15:5515:55, 26 February 2016 diff hist 0 File:Charge hania.PNG Hnt14 uploaded a new version of File:Charge hania.PNG current
• 15:5215:52, 26 February 2016 diff hist +153 ModXYZ1234 No edit summary Tag: Visual edit
• 15:5115:51, 26 February 2016 diff hist 0 N File:Charge hania.PNG No edit summary
• 15:4115:41, 26 February 2016 diff hist 0 N File:Ch4 vib hania.png No edit summary current
• 15:3815:38, 26 February 2016 diff hist +428 ModXYZ1234 No edit summary
• 15:3015:30, 26 February 2016 diff hist 0 N File:H2 OPTIMISATION HANIAT.LOG No edit summary current
• 15:2915:29, 26 February 2016 diff hist 0 N File:N2 OPTIMISATION HANIATA.LOG No edit summary current
• 15:2815:28, 26 February 2016 diff hist +21 ModXYZ1234 No edit summary
• 15:2515:25, 26 February 2016 diff hist +548 ModXYZ1234 No edit summary
• 14:1414:14, 26 February 2016 diff hist +7 ModXYZ1234 No edit summary
• 12:5512:55, 26 February 2016 diff hist +10 ModXYZ1234 No edit summary
• 12:5312:53, 26 February 2016 diff hist +229 ModXYZ1234 No edit summary
• 12:4812:48, 26 February 2016 diff hist +234 ModXYZ1234 No edit summary
• 12:3412:34, 26 February 2016 diff hist +264 ModXYZ1234 No edit summary
• 12:1612:16, 26 February 2016 diff hist +13 ModXYZ1234 No edit summary
• 12:0712:07, 26 February 2016 diff hist +285 ModXYZ1234 No edit summary
• 10:5210:52, 26 February 2016 diff hist +95 ModXYZ1234 No edit summary
• 10:4110:41, 26 February 2016 diff hist +410 ModXYZ1234 No edit summary
• 10:3010:30, 26 February 2016 diff hist 0 File:Nh3 vib print ht.png Hnt14 uploaded a new version of File:Nh3 vib print ht.png current
• 10:3010:30, 26 February 2016 diff hist +128 ModXYZ1234 No edit summary
• 10:0410:04, 26 February 2016 diff hist 0 N File:Nh3 vib print ht.png No edit summary
• 09:4309:43, 26 February 2016 diff hist −1 ModXYZ1234 No edit summary
• 09:4009:40, 26 February 2016 diff hist +189 ModXYZ1234 No edit summary
• 09:3609:36, 26 February 2016 diff hist 0 File:NH3 OPTIMISATION HANIAT.LOG Hnt14 uploaded a new version of File:NH3 OPTIMISATION HANIAT.LOG current

25 February 2016

• 18:0918:09, 25 February 2016 diff hist 0 N File:Nh3 optimisation haniat.jpg No edit summary current
• 18:0218:02, 25 February 2016 diff hist 0 N File:NH3 OPTIMISATION HANIAT.LOG No edit summary
• 17:5917:59, 25 February 2016 diff hist +535 N ModXYZ1234 Created page with "NH3 molecule N-H bond distance = 1.01798 H-N-H bond angle = 37.129 Calculation Type: FREQ Calculation Method: RB3LYP Basis Set: 6-31G(d,p) E(RB3LYP): -56.55776873 a.u...."