Uploads by Mde14
This special page shows all uploaded files.
| Date | Name | Thumbnail | Size | Description | Versions |
|---|---|---|---|---|---|
| 22:45, 15 December 2016 | Mde1490DEG ROTATED CHELETROPIC REACTION OPTMIN PM6.LOG (file) |  |
924 KB | alternative cheletropic test - mde14 | 1 |
| 22:43, 15 December 2016 | IRC CHELE REACTION.LOG (file) | |
1.53 MB | irc of chele - mde14 | 1 |
| 22:42, 15 December 2016 | IRC REACTION.LOG (file) | |
1.06 MB | irc exo reaction - mde14 | 1 |
| 22:41, 15 December 2016 | Endo IRC PM6.LOG (file) | |
924 KB | irc of endo diels ex 3 - mde14 | 1 |
| 22:37, 15 December 2016 | Exo ts vibe.gif (file) |  |
430 KB | exo ts vibe - mde14 | 1 |
| 22:36, 15 December 2016 | Endo ts vibe.gif (file) |  |
474 KB | endo ts vibe - mde14 | 1 |
| 22:35, 15 December 2016 | Chele ts vibe.gif (file) |  |
482 KB | ts chele vibration - mde14 | 1 |
| 22:28, 15 December 2016 | Mde14UNFROZEN CHELE TSBERNY PM6 - converged.LOG (file) | |
249 KB | cheletropic ts - mde14 | 1 |
| 22:26, 15 December 2016 | Mde14Endo TSBERNY PM6 worked.LOG (file) | |
327 KB | endo ts for diels alder product - mde14 | 1 |
| 22:25, 15 December 2016 | Mde14exoUNFROZEN TSBERNY PM6 worked.LOG (file) | |
215 KB | ts of exo diels alder ex 3 - mde14 | 1 |
| 22:12, 15 December 2016 | Mde14Exo ts vibe.gif (file) |  |
575 KB | exo ts vibe - mde14 | 1 |
| 22:11, 15 December 2016 | Mde14Endo ts animated.gif (file) |  |
961 KB | ts endo animated | 1 |
| 21:29, 15 December 2016 | EXO B3LYP OPTMIN.LOG (file) | |
767 KB | exo product of exercise 2 - mde14 | 1 |
| 21:27, 15 December 2016 | EXO B3LYP TSBERNY - worked.LOG (file) | |
465 KB | exo ts for exercise 2 - mde14 | 1 |
| 21:26, 15 December 2016 | Mde14Endoproduct final.log (file) | |
615 KB | endo product exercise 2 - mde14 | 1 |
| 21:25, 15 December 2016 | Mde14Ts endo b3lyp.log (file) | |
464 KB | ts for endo product exercise 2 - mde14 | 1 |
| 21:22, 15 December 2016 | Mde14DIOXOLE OPTB3LYP.LOG (file) | |
116 KB | dioxole opt and freq b3lyp - mde14 | 1 |
| 21:21, 15 December 2016 | Mde14CYCLOHEXA OPTB3LYP.LOG (file) | |
177 KB | cyclohexadiene opt b3lyp - mde14 | 1 |
| 21:02, 15 December 2016 | Mde14THURSDAY IRC BUT+ETH PM6.LOG (file) | |
725 KB | IRC of the reaction between ethene and butadiene - mde14 | 1 |
| 20:59, 15 December 2016 | Mde14PRODUCT REOPTIMISE PM6 CYCLOHEXADIENE.LOG (file) | |
140 KB | pm6 optimised exercise one product | 1 |
| 20:57, 15 December 2016 | Mde14TS BUT+ETHENE PM6 AFTERFREEZING - worked.LOG (file) | |
244 KB | mde14 | 1 |
| 20:57, 15 December 2016 | Mde14ETHENE INITOPT.LOG (file) | |
96 KB | pm6 opt of ethene | 1 |
| 20:21, 15 December 2016 | Exercise 3 scheme actual.png (file) |  |
54 KB | ex 3 scheme real - mde14 | 1 |
| 20:19, 15 December 2016 | Exercise 3 scheme.png (file) |  |
55 KB | ex 3 scheme | 1 |
| 20:05, 15 December 2016 | Xylyl altern rxn.png (file) |  |
18 KB | alternate rxn for xylylene - mde14 | 1 |
| 19:49, 15 December 2016 | Reactiontwo.png (file) |  |
41 KB | endo exo rxm scheme - mde14 | 1 |
| 19:37, 15 December 2016 | Reaction - eth but - hex.png (file) |  |
16 KB | rxn scheme 1 - mde14 | 1 |
| 19:28, 15 December 2016 | Comparitive graph pes.png (file) |  |
89 KB | comparing endo exo chele irc- mde14 | 1 |
| 17:53, 15 December 2016 | Chele irc graph.png (file) |  |
494 KB | chele irc graph - mde14 | 1 |
| 17:41, 15 December 2016 | Exo irc graph.png (file) |  |
490 KB | exo irc - mde14 | 1 |
| 17:39, 15 December 2016 | Endo irc graph.png (file) |  |
649 KB | endo irc graph - mde14 | 2 |
| 17:25, 15 December 2016 | Irc endo gif.gif (file) |  |
603 KB | endo irc gif - mde14 | 1 |
| 17:23, 15 December 2016 | Irc chele gif.gif (file) |  |
1.5 MB | chele irc mde14 | 1 |
| 17:21, 15 December 2016 | Irc exo gif.gif (file) |  |
695 KB | irc of the exo diels alder interaction - mde14 | 1 |
| 15:54, 15 December 2016 | Graph of exo irc.png (file) |  |
542 KB | exo energy irc - mde14 | 1 |
| 15:51, 15 December 2016 | Graph of endo irc.png (file) |  |
775 KB | endo irc energy profile | 1 |
| 14:39, 15 December 2016 | TS LUMO + 2- oxole lumo and cyclo homo.jpg (file) |  |
73 KB | endo ts lumo + 1- mde14 | 1 |
| 14:38, 15 December 2016 | TS LUMO - oxole homo and cyclo lumo.jpg (file) |  |
78 KB | endo ts lumo - mde14 | 1 |
| 14:37, 15 December 2016 | TS HOMO - oxole homo and cyclo lumo.jpg (file) |  |
78 KB | ts endo homo - mde14 | 1 |
| 14:36, 15 December 2016 | TS HOMO - 1 - oxole lumo and cyclo homo.jpg (file) |  |
69 KB | endo homo-1 ts - mde14 | 1 |
| 14:23, 15 December 2016 | ENDO - TS LUMO+1 - oxole lumo and diene homo.jpg (file) |  |
60 KB | endo lumo + 1 ts - mde14 | 1 |
| 14:21, 15 December 2016 | ENDO - TS LUMO - oxole homo and diene lumo.jpg (file) |  |
61 KB | exo lumo ts - mde14 | 1 |
| 14:20, 15 December 2016 | ENDO - TS HOMO - oxole homo and diene lumo.jpg (file) |  |
61 KB | homo of exo ts - mde14 | 1 |
| 14:16, 15 December 2016 | Mde14ENDO - TS HOMO-1 - oxole lumo and diene homo.jpg (file) |  |
58 KB | endo ts homo -1 - mde14 | 1 |
| 13:52, 15 December 2016 | Gaussian ethene irc.gif (file) |  |
179 KB | irc ts to product - mde14 | 1 |
| 13:50, 15 December 2016 | Mde14Gaussian vibration for ts.gif (file) |  |
620 KB | ts vibe - mde14 | 1 |
| 13:08, 15 December 2016 | Mde14Graph of changing c-c.png (file) |  |
85 KB | graph of changing c-c lengths | 1 |
| 15:21, 14 December 2016 | Mde14TS LUMO+1 - buta homo + ethene lumo.jpg (file) |  |
256 KB | LUMO+1 of the TS - mde14 | 1 |
| 15:17, 14 December 2016 | Mde14TS LUMO - buta lumo + ethene homo.jpg (file) |  |
263 KB | LUMO of TS - mde14 | 1 |
| 15:15, 14 December 2016 | Mde14TS HOMO - buta lumo + ethene homo.jpg (file) |  |
207 KB | TS HOMO - mde14 | 1 |
