Uploads by Sc3916
This special page shows all uploaded files.
| Date | Name | Thumbnail | Size | Description | Versions |
|---|---|---|---|---|---|
| 11:28, 20 March 2017 | Sc3916 optf totalenergyplot.jpg (file) |  |
97 KB | Optimisation energy plot | 1 |
| 11:58, 20 March 2017 | Sc3916 displayvibrationsscreenshot.png (file) |  |
16 KB | Display Vibrations | 1 |
| 17:03, 23 March 2017 | SC3916 N2 REALOPT.LOG (file) |  |
196 KB | 1 | |
| 17:40, 23 March 2017 | SC3916 CLF3 OPT.LOG (file) | |
592 KB | ClF3 optimisation | 1 |
| 18:39, 23 March 2017 | Sc3916 lumo.png (file) |  |
61 KB | 2 | |
| 18:43, 23 March 2017 | Sc3916 homo.png (file) |  |
51 KB | 1 | |
| 18:45, 23 March 2017 | Sc3916 homo-1.png (file) |  |
41 KB | 1 | |
| 18:45, 23 March 2017 | Sc3916 homo-2.png (file) |  |
42 KB | 1 | |
| 18:46, 23 March 2017 | Sc3916 homo-3.png (file) |  |
45 KB | 1 | |
| 18:50, 23 March 2017 | Sc3916 lumo+1.png (file) |  |
57 KB | 1 | |
| 19:12, 23 March 2017 | Nh3 new opt.log (file) | |
228 KB | 1 | |
| 19:20, 23 March 2017 | Sc3916 OPT1 INPUT (this is opt log file).LOG (file) | |
228 KB | nh3 log file | 2 |
| 19:27, 23 March 2017 | SC3916 H2 OPT.LOG (file) | |
95 KB | 2 | |
| 19:29, 23 March 2017 | SC3916 CN OPT.LOG (file) | |
194 KB | 2 | |
| 13:55, 8 May 2018 | Sc3916 BH3 summary.PNG (file) |  |
9 KB | Summary of BH3 optimisation | 1 |
| 13:58, 8 May 2018 | Sc 3916 BH3 summary.PNG (file) |  |
12 KB | 1 | |
| 14:06, 8 May 2018 | SC3916 BH3 FREQ.LOG (file) | |
73 KB | Frequency optimisation of BH3 - log file | 1 |
| 14:38, 8 May 2018 | BH3 vibrational spectrum.PNG (file) |  |
11 KB | 2 | |
| 15:32, 8 May 2018 | Bh3 mo diagram.PNG (file) |  |
96 KB | 2 | |
| 15:57, 8 May 2018 | Nh3 summary.PNG (file) |  |
10 KB | 1 | |
| 16:12, 8 May 2018 | SC3916 NH3 FREQ.LOG (file) | |
73 KB | 1 | |
| 16:13, 8 May 2018 | NH3 6-31G OPT.LOG (file) | |
39 KB | Reverted to version as of 13:53, 15 October 2012 | 4 |
| 16:13, 8 May 2018 | Sc3916 NH3 6-31G OPT.LOG (file) | |
45 KB | 1 | |
| 16:29, 8 May 2018 | Bh3 summary opt.PNG (file) |  |
10 KB | 1 | |
| 12:51, 9 May 2018 | Sc NH3BH3 631G OPT FREQ.LOG (file) | |
271 KB | 1 | |
| 12:52, 9 May 2018 | Sc NH3BH3 631G OPT.LOG (file) | |
70 KB | 1 | |
| 12:13, 10 May 2018 | Sc Bbr3 summary.PNG (file) |  |
9 KB | 1 | |
| 13:28, 10 May 2018 | Sc Nh3bh3 6-31g summary.PNG (file) |  |
10 KB | 2 | |
| 13:29, 10 May 2018 | Sc3916 Nh3bh3 6-31g summary.PNG (file) |  |
10 KB | 1 | |
| 13:37, 10 May 2018 | Sc3916 NH3BH3 FREQ.LOG (file) | |
182 KB | 1 | |
| 13:38, 10 May 2018 | Sc3916 NH3BH3 631G.LOG (file) | |
62 KB | 1 | |
| 13:54, 10 May 2018 | Bbr3summary.PNG (file) |  |
10 KB | 1 | |
| 13:54, 10 May 2018 | Sc Bbr3summary.PNG (file) |  |
10 KB | 1 | |
| 14:19, 10 May 2018 | Bh3 opt d3h.PNG (file) |  |
10 KB | 1 | |
| 14:24, 10 May 2018 | SC3916 BH3 FREQ SYM OPT.LOG (file) | |
73 KB | 1 | |
| 14:25, 10 May 2018 | SC3916 BH3 OPT SYM OPT.LOG (file) | |
21 KB | 1 | |
| 14:30, 10 May 2018 | Sc3916 Nh3 summary.PNG (file) |  |
11 KB | 4 | |
| 14:32, 10 May 2018 | Ssc Nh3 summary2.PNG (file) |  |
11 KB | 1 | |
| 14:46, 10 May 2018 | Freqanalysisofbbr3 sc.log (file) | |
113 KB | 1 | |
| 14:48, 10 May 2018 | Sc hpc bbr3 opt.log (file) | |
50 KB | 1 | |
| 14:58, 10 May 2018 | Sc N(me)4+ summary.PNG (file) | 4%2B_summary.PNG) |
10 KB | 1 | |
| 14:59, 10 May 2018 | SC N(CH3)3+ 631G AFTERSYM.LOG (file) | |
56 KB | 1 | |
| 15:15, 10 May 2018 | SC N(CH3)3+ 631G FREQ.LOG (file) | |
698 KB | 1 | |
| 15:28, 10 May 2018 | P summary sc3916.PNG (file) |  |
10 KB | 1 | |
| 15:44, 10 May 2018 | SC P(CH3)4+ 631G FREQ.LOG (file) | |
734 KB | 1 | |
| 15:46, 10 May 2018 | SC P(CH3)4+ 631G.LOG (file) | |
160 KB | 1 | |
| 15:49, 10 May 2018 | SC3916 P(CH3)4+ 631G FREQ.LOG (file) | |
734 KB | 1 | |
| 17:37, 10 May 2018 | Sc3916 N charge.PNG (file) |  |
220 KB | 1 | |
| 17:37, 10 May 2018 | Sc3916 P charge.PNG (file) |  |
190 KB | 1 | |
| 18:14, 10 May 2018 | Sc Nh3bh3 summ.PNG (file) |  |
10 KB | 1 |
