Uploads by Ps4615
This special page shows all uploaded files.
| Date | Name | Thumbnail | Size | Description | Versions |
|---|---|---|---|---|---|
| 15:44, 15 February 2016 | PHunt nh3 optf pop ps4615.gjf (file) |  |
442 bytes | 1 | |
| 15:50, 15 February 2016 | NH3 OPTF POP PS4615.LOG (file) | |
228 KB | 2 | |
| 16:38, 15 February 2016 | Display vibrations of nh3.PNG (file) |  |
22 KB | 1 | |
| 17:05, 15 February 2016 | Nh3 atomic charges.PNG (file) |  |
40 KB | 1 | |
| 14:07, 18 February 2016 | N2 optimized molecule.PNG (file) |  |
20 KB | 1 | |
| 14:08, 18 February 2016 | N2 OPTF POP PS4615.LOG (file) | |
197 KB | 1 | |
| 14:10, 18 February 2016 | Nh3 molecule.PNG (file) |  |
30 KB | 1 | |
| 14:59, 18 February 2016 | H2 molecule.PNG (file) |  |
15 KB | 1 | |
| 15:02, 18 February 2016 | H2 OPTF PS4615.LOG (file) | |
95 KB | 1 | |
| 16:31, 18 February 2016 | H2o molecule.PNG (file) |  |
16 KB | 1 | |
| 16:48, 18 February 2016 | H20 OPTF POP PS4615.LOG (file) | |
166 KB | 1 | |
| 13:24, 19 February 2016 | H2o vibrations.PNG (file) |  |
17 KB | 1 | |
| 13:32, 19 February 2016 | H2o charge distribution.PNG (file) |  |
33 KB | 1 | |
| 13:54, 19 February 2016 | H2o mo1.png (file) |  |
24 KB | 3 | |
| 13:56, 19 February 2016 | H2o mo2.png (file) |  |
74 KB | 1 | |
| 14:00, 19 February 2016 | H2o mo4.png (file) |  |
99 KB | 1 | |
| 14:05, 19 February 2016 | H2o mo5.png (file) |  |
85 KB | 1 | |
| 14:05, 19 February 2016 | H2o mo6.png (file) |  |
23 KB | 1 | |
| 15:29, 19 February 2016 | NH3 OPTF POP PS4615.log (file) | |
228 KB | 1 | |
| 15:36, 19 February 2016 | N2 OPTF POP PS4615.log (file) | |
197 KB | 1 | |
| 15:38, 19 February 2016 | H2 OPTF PS4615.log (file) | |
95 KB | 1 | |
| 15:40, 19 February 2016 | H20 OPTF POP PS4615.log (file) | |
166 KB | 1 | |
| 15:55, 19 February 2016 | H2o mo diagram.gif (file) |  |
3 KB | 1 | |
| 13:45, 18 May 2017 | PES TS Q2.PNG (file) |  |
85 KB | 2 | |
| 14:01, 18 May 2017 | Q2 internuclear distance.PNG (file) |  |
18 KB | 1 | |
| 14:11, 20 May 2017 | Q3 1.PNG (file) |  |
154 KB | 1 | |
| 14:15, 20 May 2017 | Q3 2.PNG (file) |  |
161 KB | 1 | |
| 12:03, 21 May 2017 | Figure1 whole trajectory.PNG (file) |  |
109 KB | 1 | |
| 12:11, 21 May 2017 | Figure2 TS.PNG (file) |  |
107 KB | 1 | |
| 12:17, 21 May 2017 | Figure3 TS trajectory.PNG (file) |  |
109 KB | 1 | |
| 12:20, 21 May 2017 | Figure4 TS trajectory DvsT plot.PNG (file) |  |
47 KB | 1 | |
| 12:36, 21 May 2017 | Figure5 MEPvsDynamic.PNG (file) |  |
354 KB | 1 | |
| 12:47, 21 May 2017 | Figure6 MEP 20000s.PNG (file) |  |
154 KB | 1 | |
| 12:50, 21 May 2017 | Figure6 MEP 20000.PNG (file) |  |
133 KB | 1 | |
| 12:51, 21 May 2017 | Figure7 Dynamic .PNG (file) |  |
140 KB | 1 | |
| 12:55, 21 May 2017 | Figure7Dynamic.png (file) |  |
140 KB | 1 | |
| 13:05, 21 May 2017 | Figure8 calculating reaction path.PNG (file) |  |
237 KB | 1 | |
| 13:31, 21 May 2017 | Figure9 1.PNG (file) |  |
110 KB | 1 | |
| 13:42, 21 May 2017 | Figure10 2.PNG (file) |  |
108 KB | 1 | |
| 13:48, 21 May 2017 | Figure11 3.PNG (file) |  |
110 KB | 1 | |
| 13:54, 21 May 2017 | Figure12 4.PNG (file) |  |
114 KB | 1 | |
| 14:00, 21 May 2017 | Figure13 5.PNG (file) |  |
112 KB | 1 | |
| 14:34, 21 May 2017 | Figure14 reaction profile.PNG (file) |  |
75 KB | 1 | |
| 14:57, 21 May 2017 | Figure15 ts1.PNG (file) |  |
90 KB | 1 | |
| 14:58, 21 May 2017 | Figure15 ts2.PNG (file) |  |
47 KB | 1 | |
| 15:40, 21 May 2017 | Figure16 combinedMEP.PNG (file) |  |
434 KB | 1 | |
| 15:51, 21 May 2017 | Figure17 reactive.PNG (file) |  |
97 KB | 1 | |
| 14:40, 12 November 2017 | ILCheck.png (file) |  |
55 KB | 2 | |
| 13:06, 14 November 2017 | Finalframe 5050 1.png (file) |  |
29 KB | 1 | |
| 13:18, 14 November 2017 | Finalframe 5050 5.png (file) |  |
30 KB | 1 |
