User contributions for Am5713

5 February 2016

• 12:5912:59, 5 February 2016 diff hist 0 N File:Ethene butadiene irc curves.PNG No edit summary current
• 12:3512:35, 5 February 2016 diff hist 0 N File:Ethene butadiene ts LUMO am5713.PNG No edit summary current
• 12:3312:33, 5 February 2016 diff hist 0 N File:Ethene butadiene ts HOMO AM5713.PNG No edit summary current
• 12:2512:25, 5 February 2016 diff hist 0 N File:Ethene butadiene ts lowest real vibation.gif No edit summary current
• 12:2412:24, 5 February 2016 diff hist 0 N File:Ethene butadiene ts imaginary vibation.gif No edit summary current
• 12:2112:21, 5 February 2016 diff hist 0 N File:Ethene butadiene ts vib list.PNG No edit summary current
• 11:4411:44, 5 February 2016 diff hist +2,517 Rep:AM4463 →Diels-Alder Cycloaddition
• 11:3311:33, 5 February 2016 diff hist 0 N File:Ethene butadiene ts energy am5713.PNG No edit summary current
• 11:2211:22, 5 February 2016 diff hist 0 N File:ETHENE BUTADIENE TS GUESS 2 BERNY am5713.mol No edit summary current
• 11:2011:20, 5 February 2016 diff hist 0 N File:Ethene input structure for ts calculation am5713.mol No edit summary current
• 11:0211:02, 5 February 2016 diff hist 0 N File:BUTADIENE AM1 am5713a.mol No edit summary current
• 11:0111:01, 5 February 2016 diff hist 0 N File:Butadiene energy am5713.PNG No edit summary current
• 11:0011:00, 5 February 2016 diff hist 0 N File:Butadiene LUMO am5713.PNG No edit summary current
• 10:5910:59, 5 February 2016 diff hist 0 N File:Butadiene HOMO am5713.PNG No edit summary current
• 10:5310:53, 5 February 2016 diff hist 0 N File:Ethene LUMO am5713.PNG No edit summary current
• 10:5110:51, 5 February 2016 diff hist 0 File:Ethene energy am5713.PNG Am5713 uploaded a new version of File:Ethene energy am5713.PNG current
• 10:4910:49, 5 February 2016 diff hist 0 N File:Ethene energy am5713.PNG No edit summary
• 10:4610:46, 5 February 2016 diff hist 0 N File:Ethene HOMO am5713.PNG No edit summary current
• 10:4510:45, 5 February 2016 diff hist 0 N File:ETHENE AM1 am5713.mol No edit summary current
• 10:4110:41, 5 February 2016 diff hist +753 Rep:AM4463LogFiles →test site2
• 10:3910:39, 5 February 2016 diff hist +68 Rep:AM4463 →Diels-Alder Cycloaddition
• 10:3810:38, 5 February 2016 diff hist +570 Rep:AM4463 →Optimising the Chair and Boat Transition Structures
• 10:1710:17, 5 February 2016 diff hist +34 Rep:AM4463 →Intrinsic Reaction Coordinate

4 February 2016

• 16:5616:56, 4 February 2016 diff hist +701 Rep:AM4463LogFiles →Log Files Link-Dump
• 16:2616:26, 4 February 2016 diff hist 0 N File:CYCLOHEXENE IRC PRODUCT AM1 OPT TO MINIMUM.LOG No edit summary current
• 16:2216:22, 4 February 2016 diff hist 0 N File:ETHENE BUTADIENE TS IRC BOTH100.LOG No edit summary current
• 16:1616:16, 4 February 2016 diff hist 0 N File:ETHENE BUTADIENE TS GUESS 2 BERNY(AM1).LOG No edit summary current
• 16:1316:13, 4 February 2016 diff hist 0 N File:ETHENE BUTADIENE TS GUESS 1 BERNY(AM1).LOG No edit summary current
• 16:1216:12, 4 February 2016 diff hist 0 N File:BUTADIENE AM1 am5713.LOG No edit summary current
• 16:1116:11, 4 February 2016 diff hist 0 N File:ETHENE AM1 am5713.LOG No edit summary current
• 16:0416:04, 4 February 2016 diff hist +228 Rep:AM4463LogFiles →Chair and Boat Transition Structures
• 16:0416:04, 4 February 2016 diff hist 0 N File:BOAT IRC STRUCTURE HF OPTIMISATION TO MIN.LOG No edit summary current
• 16:0116:01, 4 February 2016 diff hist 0 N File:OPT TO MIN OF FINAL IRC STRUCTURE HF.LOG No edit summary current
• 15:5815:58, 4 February 2016 diff hist +21 Rep:AM4463 →Intrinsic Reaction Coordinate
• 15:5715:57, 4 February 2016 diff hist +513 Rep:AM4463 →Intrinsic Reaction Coordinate
• 15:5515:55, 4 February 2016 diff hist 0 N File:Boat irc optimised structure energy.PNG No edit summary current
• 15:5115:51, 4 February 2016 diff hist 0 N File:Boat irc final structure energy.png No edit summary current
• 15:4215:42, 4 February 2016 diff hist 0 N File:Chair irc energy of optimised structure.png No edit summary current
• 15:4015:40, 4 February 2016 diff hist 0 N File:Chair irc energy of final structure.png No edit summary current

3 February 2016

• 22:1222:12, 3 February 2016 diff hist −2 Rep:AM4463 →Optimising the Chair and Boat Transition Structures
• 22:0922:09, 3 February 2016 diff hist +3,064 Rep:AM4463 →Optimising the Chair and Boat Transition Structures
• 18:0218:02, 3 February 2016 diff hist +1,673 Rep:AM4463 →Intrinsic Reaction Coordinate
• 17:3317:33, 3 February 2016 diff hist −1 Rep:AM4463 →Anti 2 Conformation
• 17:2717:27, 3 February 2016 diff hist +1,518 Rep:AM4463 →Intrinsic Reaction Coordinate
• 16:4416:44, 3 February 2016 diff hist +501 Rep:AM4463 →The Lowest Energy Conformation
• 16:2116:21, 3 February 2016 diff hist +16 Rep:AM4463 →Transition Structures and Reactivity
• 16:1416:14, 3 February 2016 diff hist +2,545 Rep:AM4463 →The Lowest Energy Conformation
• 15:1415:14, 3 February 2016 diff hist +925 Rep:AM4463LogFiles →test site2
• 14:1114:11, 3 February 2016 diff hist +1 Rep:AM4463LogFiles →test site2
• 14:1014:10, 3 February 2016 diff hist +219 Rep:AM4463LogFiles →test site2