Main public logs

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• 16:05, 15 December 2016 Hjt14 talk contribs uploaded File:Endo TS IRC energy profile hjt14.PNG (Exercise 3 endo TS IRC energy profile)
• 15:51, 15 December 2016 Hjt14 talk contribs uploaded File:Endo TS IRC v2 hjt14.gif (Exercise 3 endo TS IRC gif v2)
• 15:49, 15 December 2016 Hjt14 talk contribs uploaded a new version of File:Endo TS hjt14.gif
• 15:49, 15 December 2016 Hjt14 talk contribs uploaded a new version of File:Endo TS hjt14.gif
• 15:23, 15 December 2016 Hjt14 talk contribs uploaded File:Cheletropic IRC hjt14.gif (Exercise 3 cheletropic TS gif)
• 15:21, 15 December 2016 Hjt14 talk contribs uploaded File:Exo TS hjt14.gif (Exercise 3 exo TS gif)
• 15:20, 15 December 2016 Hjt14 talk contribs uploaded File:Endo TS hjt14.gif (Exercise 3 endo rxn gif)
• 15:16, 15 December 2016 Hjt14 talk contribs uploaded File:Exercise 2 energy profile (endo and exo) v3 hjt14.PNG (Exercise 2 energy profile v3)
• 14:46, 15 December 2016 Hjt14 talk contribs uploaded File:Endo TS secondary orbital interaction hjt14.PNG (Exercise 2 endo TS Secondary Orbital Interaction)
• 14:10, 15 December 2016 Hjt14 talk contribs uploaded File:Exercise 2 energy profile (endo and exo) v2 hjt14.png (Exercise 2 energy profile (endo and exo) v2)
• 14:06, 15 December 2016 Hjt14 talk contribs uploaded File:Exercise 2 energy profile (endo and exo) hjt14.png (Exercise 2 energy profile)
• 13:37, 15 December 2016 Hjt14 talk contribs uploaded File:Dioxole hexadiene DA exoTS opt fre dft B3LYP631Gd LUMO+1.PNG (Exercise 2 exo TS LUMO+1)
• 13:36, 15 December 2016 Hjt14 talk contribs uploaded File:Dioxole hexadiene DA exoTS opt fre dft B3LYP631Gd LUMO hjt14.PNG (Exercise 2 exo TS LUMO)
• 13:35, 15 December 2016 Hjt14 talk contribs uploaded File:Dioxole hexadiene DA exoTS opt fre dft B3LYP631Gd HOMO hjt14.PNG (Exercise 2 exo TS HOMO)
• 13:34, 15 December 2016 Hjt14 talk contribs uploaded File:Dioxole hexadiene DA exoTS opt fre dft B3LYP631Gd HOMO-1 hjt14.PNG (Exercise 2 exo TS HOMO-1)
• 13:33, 15 December 2016 Hjt14 talk contribs uploaded File:Dioxole hexadiene DA endoTS opt fre dft B3LYP631Gd noeigen LUMO+1 hjt14.PNG (Exercise 2 endo TS LUMO+1)
• 13:32, 15 December 2016 Hjt14 talk contribs uploaded File:Dioxole hexadiene DA endoTS opt fre dft B3LYP631Gd noeigen LUMO.PNG (Exercise 2 endo TS LUMO)
• 13:31, 15 December 2016 Hjt14 talk contribs uploaded File:Dioxole hexadiene DA endoTS opt fre dft B3LYP631Gd noeigen HOMO hjt14.PNG (Exercise 2 endo TS HOMO)
• 13:30, 15 December 2016 Hjt14 talk contribs uploaded File:Dioxole hexadiene DA endoTS opt fre dft B3LYP631Gd noeigen HOMO-1 hjt14.PNG (Exercise 2 endo TS HOMO-1)
• 13:09, 15 December 2016 Hjt14 talk contribs uploaded File:Cyclohexadiene opt fre dft B3LYP631Gd LUMO+1 hjt14.PNG (Exercise 2 cyclohexadiene LUMO+1)
• 13:08, 15 December 2016 Hjt14 talk contribs uploaded File:Cyclohexadiene opt fre dft B3LYP631Gd LUMO hjt14.PNG (Exercise 2 cyclohexadiene LUMO)
• 13:06, 15 December 2016 Hjt14 talk contribs uploaded File:Cyclohexadiene opt fre dft B3LYP631Gd HOMO-1.PNG (Exercise 2 cyclohexadiene HOMO-1)
• 13:06, 15 December 2016 Hjt14 talk contribs uploaded File:Cyclohexadiene opt fre dft B3LYP631Gd HOMO hjt14.PNG (Exercise 2 cyclohexadiene HOMO)
• 13:04, 15 December 2016 Hjt14 talk contribs uploaded File:13 dioxole opt fre dft B3LYP631Gd breaksym LUMO+1 hjt14.PNG (Exercise 2 13 dioxole LUMO+1)
• 13:03, 15 December 2016 Hjt14 talk contribs uploaded File:13 dioxole opt fre dft B3LYP631Gd breaksym LUMO hjt14.PNG (Exercise 2 13 dioxole LUMO)
• 13:02, 15 December 2016 Hjt14 talk contribs uploaded File:13 dioxole opt fre dft B3LYP631Gd breaksym HOMO-1 hjt14.PNG (Exercise 2 13 dioxole HOMO-1)
• 12:55, 15 December 2016 Hjt14 talk contribs uploaded File:13 dioxole opt fre dft B3LYP631Gd breaksym HOMO hjt14.PNG (Exercise 2 1,3 dioxole HOMO)
• 23:36, 14 December 2016 Hjt14 talk contribs uploaded a new version of File:Exercise 1 MO diagram thj14.jpg (Exercise 1 MO diagram)
• 23:35, 14 December 2016 Hjt14 talk contribs uploaded a new version of File:Exercise 1 MO diagram thj14.jpg (Reverted to version as of 23:33, 14 December 2016)
• 23:34, 14 December 2016 Hjt14 talk contribs uploaded a new version of File:Exercise 1 MO diagram thj14.jpg (Reverted to version as of 23:31, 14 December 2016)
• 23:33, 14 December 2016 Hjt14 talk contribs uploaded a new version of File:Exercise 1 MO diagram thj14.jpg
• 23:31, 14 December 2016 Hjt14 talk contribs uploaded a new version of File:Exercise 1 MO diagram thj14.jpg
• 23:26, 14 December 2016 Hjt14 talk contribs uploaded File:Exercise 2 reaction scheme hjt14.jpg (Exercise 2 reaction scheme)
• 23:12, 14 December 2016 Hjt14 talk contribs uploaded File:Exercise 1 sym requirement hjt14.jpg (Exercise 1 symmetry requirement for orbital interaction)
• 22:20, 14 December 2016 Hjt14 talk contribs uploaded File:42cycloaddition TS opt fre sem pm6 LUMO+1 hjt14.PNG (Exercise 1 TS LUMO+1)
• 22:19, 14 December 2016 Hjt14 talk contribs uploaded File:42cycloaddition TS opt fre sem pm6 LUMO hjt14.PNG (Exercise 1 TS LUMO)
• 22:17, 14 December 2016 Hjt14 talk contribs uploaded File:42cycloaddition TS opt fre sem pm6 HOMO hjt14.PNG (Exercise 1 TS HOMO)
• 22:17, 14 December 2016 Hjt14 talk contribs uploaded File:42cycloaddition TS opt fre sem pm6 HOMO-1 hjt14.PNG (Exercise 1 TS HOMO-1)
• 22:00, 14 December 2016 Hjt14 talk contribs uploaded File:Exercise 1 mirror plane hjt14.jpg (Exercise 1 plane of symmetry)
• 21:48, 14 December 2016 Hjt14 talk contribs uploaded a new version of File:Exercise 1 MO diagram thj14.jpg
• 21:28, 14 December 2016 Hjt14 talk contribs uploaded File:Exercise 1 MO diagram thj14.jpg (MO diagram for exercise 1)
• 20:17, 14 December 2016 Hjt14 talk contribs uploaded File:Ethene opt fre sem pm6 LUMO thj14.PNG (Exercise 1 ethene LUMO)
• 20:14, 14 December 2016 Hjt14 talk contribs uploaded File:Ethene opt fre sem pm6 HOMO thj14.PNG (Exercise 1 ethene HOMO)
• 20:13, 14 December 2016 Hjt14 talk contribs uploaded File:S cis butadiene opt fre sem pm6 breaksym LUMO thj14.PNG (Exercise 1 butadiene LUMO)
• 20:11, 14 December 2016 Hjt14 talk contribs uploaded File:S cis butadiene opt fre sem pm6 breaksym HOMO thj14.PNG (Exercise 1 Butadiene HOMO)
• 18:56, 14 December 2016 Hjt14 talk contribs uploaded File:Exercise 1 scheme hjt14.jpg (Reaction scheme for exercise number 1)
• 17:55, 14 December 2016 Hjt14 talk contribs uploaded File:Force constant thj14.PNG (Equation for introduction.)
• 16:57, 14 December 2016 Hjt14 talk contribs uploaded File:Intro E profile diagram thj14.png (Energy Profile Diagram for Introduction)
• 13:21, 12 December 2016 Hjt14 talk contribs uploaded File:Exercise 1 scheme.jpg (Reaction scheme for DA reaction between a butadiene and an ethene.)
• 15:31, 11 December 2016 Hjt14 talk contribs uploaded File:S CIS BUTADIENE OPT FRE SEM PM6 BREAKSYM.LOG (Optimized s-cis butadiene using semiempirical method and pm6 basis set. (broke symmetry))