User contributions for Yc8512
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28 January 2016
- 15:2715:27, 28 January 2016 diff hist 0 N File:IRC AM1 Enegry and RMS gradient graph.PNG No edit summary current
- 15:1715:17, 28 January 2016 diff hist +429 Rep:Mod:ArielC →3.2.IRC Calculation of Transition structure using Semi-Empirical MO/AM1 Method
- 15:1715:17, 28 January 2016 diff hist 0 N File:IRC last bond length.PNG No edit summary current
- 15:1615:16, 28 January 2016 diff hist 0 N File:IRC 1st bond length.PNG No edit summary current
- 15:1515:15, 28 January 2016 diff hist 0 File:AM1 bond lenth before.PNG Yc8512 uploaded a new version of File:AM1 bond lenth before.PNG current
- 15:1115:11, 28 January 2016 diff hist 0 N File:IRC CALCULATION TS AM1 last point.mol No edit summary current
- 15:0915:09, 28 January 2016 diff hist 0 N File:IRC calculation animation.gif No edit summary current
- 14:3014:30, 28 January 2016 diff hist +2,257 Rep:Mod:ArielC →3.1.Optimization of Transition structure using Semi-Empirical MO/AM1 Method
- 14:2714:27, 28 January 2016 diff hist +22 Rep:Mod:ArielC →1.Optimization of Cis-butadiene
- 14:2714:27, 28 January 2016 diff hist +20 Rep:Mod:ArielC →2.Optimization of Ethylene
- 14:2614:26, 28 January 2016 diff hist +35 Rep:Mod:ArielC →3.1.Optimization of Transition structure using Semi-Empirical MO/AM1 Method
- 14:2514:25, 28 January 2016 diff hist 0 N File:AM1--HOMO-LUMO transition states.PNG No edit summary current
- 14:1014:10, 28 January 2016 diff hist +413 Rep:Mod:ArielC →3.1.Optimization of Transition structure using Semi-Empirical MO/AM1 Method
- 14:0114:01, 28 January 2016 diff hist 0 N File:AM1 bond lenth after.PNG No edit summary current
- 13:5913:59, 28 January 2016 diff hist 0 N File:AM1 bond lenth before.PNG No edit summary
- 13:5613:56, 28 January 2016 diff hist 0 Rep:Mod:ArielC →3.Optimization of Transition structure
- 13:5613:56, 28 January 2016 diff hist +924 Rep:Mod:ArielC →3.1.Optimization of Transition structure using Semi-Empirical MO/AM1 Method
- 13:4613:46, 28 January 2016 diff hist 0 N File:TS AM1 frequency table.PNG No edit summary current
- 13:4613:46, 28 January 2016 diff hist 0 File:TS AM1 OPTIMIZATION.LOG Yc8512 uploaded a new version of File:TS AM1 OPTIMIZATION.LOG current
- 13:4513:45, 28 January 2016 diff hist 0 N File:Ariel TS AM1.gif No edit summary current
- 13:3213:32, 28 January 2016 diff hist 0 File:TS AM1 OPTIMIZATION.LOG Yc8512 uploaded a new version of File:TS AM1 OPTIMIZATION.LOG
- 13:1213:12, 28 January 2016 diff hist +1,341 Rep:Mod:ArielC →2.Optimization of Ethylene
- 12:5612:56, 28 January 2016 diff hist 0 N File:TS AM1 OPTIMIZATION.LOG No edit summary
- 12:5512:55, 28 January 2016 diff hist 0 N File:TS AM1 optimization.mol No edit summary current
- 10:0210:02, 28 January 2016 diff hist 0 N File:Image 16.png No edit summary current
- 09:3309:33, 28 January 2016 diff hist −31 Rep:Mod:ArielC →2.Optimization of Ethylene
- 09:3309:33, 28 January 2016 diff hist 0 N File:Ethylene HOMO-LUMO.PNG No edit summary current
- 09:1909:19, 28 January 2016 diff hist 0 File:ETHYLENE.LOG Yc8512 uploaded a new version of File:ETHYLENE.LOG
- 09:1809:18, 28 January 2016 diff hist 0 N File:Ethylene.mol No edit summary
- 09:0709:07, 28 January 2016 diff hist 0 Rep:Mod:ArielC →1.Optimization of Ethylene
- 09:0609:06, 28 January 2016 diff hist +825 Rep:Mod:ArielC →1.Optimization of Cis-butadiene
- 09:0509:05, 28 January 2016 diff hist +65 Rep:Mod:ArielC →1.Optimization of Cis-butadiene
- 09:0409:04, 28 January 2016 diff hist 0 N File:Image 15.PNG No edit summary current
- 09:0309:03, 28 January 2016 diff hist 0 File:Image 14.PNG Yc8512 uploaded a new version of File:Image 14.PNG current
- 09:0009:00, 28 January 2016 diff hist 0 N File:Image 14.PNG No edit summary
- 08:3308:33, 28 January 2016 diff hist 0 Rep:Mod:ArielC →1.Optimization of cis-butadiene
- 08:2808:28, 28 January 2016 diff hist +6 Rep:Mod:ArielC →Results and discussion
- 08:2808:28, 28 January 2016 diff hist 0 N File:Summery 2.PNG No edit summary current
- 08:2708:27, 28 January 2016 diff hist 0 N File:Summery 1.PNG No edit summary current
- 08:2408:24, 28 January 2016 diff hist 0 File:Table 2.PNG Yc8512 uploaded a new version of File:Table 2.PNG current
- 08:2308:23, 28 January 2016 diff hist 0 File:Table 2.PNG Yc8512 uploaded a new version of File:Table 2.PNG
- 08:2308:23, 28 January 2016 diff hist 0 File:Table.PNG Yc8512 uploaded a new version of File:Table.PNG
- 08:2208:22, 28 January 2016 diff hist 0 File:Table.PNG Yc8512 uploaded a new version of File:Table.PNG
- 08:2108:21, 28 January 2016 diff hist 0 File:Table.PNG Yc8512 uploaded a new version of File:Table.PNG
- 08:2108:21, 28 January 2016 diff hist 0 File:Table.PNG Yc8512 uploaded a new version of File:Table.PNG
- 08:1508:15, 28 January 2016 diff hist 0 Rep:Mod:ArielC →-Reoptimization of the Boat transition structures
- 08:1508:15, 28 January 2016 diff hist 0 File:Boat Reoptimization frequency table.PNG Yc8512 uploaded a new version of File:Boat Reoptimization frequency table.PNG current
- 08:1408:14, 28 January 2016 diff hist 0 File:BOAT REOPTIMIZATION.LOG Yc8512 uploaded a new version of File:BOAT REOPTIMIZATION.LOG current
- 08:1408:14, 28 January 2016 diff hist 0 File:Boat Reoptimization.gif Yc8512 uploaded a new version of File:Boat Reoptimization.gif current
- 08:1208:12, 28 January 2016 diff hist 0 File:Boat Reoptimization.mol Yc8512 uploaded a new version of File:Boat Reoptimization.mol current