Uploads by Jr817
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This special page shows all uploaded files.
Date | Name | Thumbnail | Size | Description | Versions |
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15:47, 24 May 2019 | Jr817 H H-F reaction contour.PNG (file) | 127 KB | 1 | ||
13:59, 24 May 2019 | Jr817 F H2 M vs t graph.PNG (file) | 53 KB | 1 | ||
16:45, 23 May 2019 | Jr817 TS HF FLATLINE.PNG (file) | 16 KB | 1 | ||
16:26, 23 May 2019 | Jr817 TS HF 1.817.PNG (file) | 18 KB | 1 | ||
15:45, 23 May 2019 | Jr817 HHF PES.PNG (file) | 154 KB | 1 | ||
15:41, 23 May 2019 | Jr817 FHH PES.PNG (file) | 178 KB | 2 | ||
19:42, 21 May 2019 | Jr817 Table trajectory 5.PNG (file) | 123 KB | 1 | ||
19:41, 21 May 2019 | Jr817 Table trajectory 4.PNG (file) | 123 KB | 1 | ||
19:39, 21 May 2019 | Jr817 Table trajectory 3.PNG (file) | 124 KB | 2 | ||
19:37, 21 May 2019 | Jr817 Table trajectory 2.PNG (file) | 124 KB | 1 | ||
19:35, 21 May 2019 | Jr817 Table trajectory 1.PNG (file) | 124 KB | 1 | ||
19:05, 21 May 2019 | Jr817 Momenta v time r1 rts+0.01.PNG (file) | 25 KB | 1 | ||
19:05, 21 May 2019 | Jr817 Intnuc dist v time r1 rts+0.01.PNG (file) | 24 KB | 1 | ||
18:31, 21 May 2019 | Jr817 dynamics contour plot.PNG (file) | 129 KB | 1 | ||
18:31, 21 May 2019 | Jr817 mep contour plot.PNG (file) | 128 KB | 1 | ||
18:02, 21 May 2019 | Jr817 Internuclear distances v time plot 0.9075.PNG (file) | 12 KB | 1 | ||
17:57, 21 May 2019 | Jr817 Internuclear distances v time plot 0.915.PNG (file) | 15 KB | 1 | ||
17:57, 21 May 2019 | Jr817 PES determining rts 2.PNG (file) | 19 KB | 1 | ||
17:56, 21 May 2019 | Jr817 Internuclear distances v time plot 1.0.PNG (file) | 23 KB | 1 | ||
17:56, 21 May 2019 | Jr817 PES determining rts 1.PNG (file) | 117 KB | 1 | ||
15:55, 21 May 2019 | Jr817 PES q2 pic.PNG (file) | 153 KB | 1 | ||
15:54, 21 May 2019 | Jr817 PES q1 pic.PNG (file) | 141 KB | 1 | ||
16:47, 10 May 2019 | JR817 NME4 CHARGE.PNG (file) | 58 KB | 1 | ||
16:46, 10 May 2019 | JR817 PME4 CHARGE.PNG (file) | 53 KB | 1 | ||
16:23, 10 May 2019 | Jr817 Valence MOs.PNG (file) | 65 KB | 1 | ||
14:13, 10 May 2019 | JR817 NH3BH3 FREQ 3.LOG (file) | ![]() |
182 KB | 1 | |
13:16, 10 May 2019 | JR817 NH3BH3 FREQ 2.LOG (file) | ![]() |
182 KB | 1 | |
13:15, 10 May 2019 | JR817 NH3BH3 FREQ.LOG (file) | ![]() |
182 KB | 2 | |
13:11, 10 May 2019 | JR817 NH3BH3 summary table.PNG (file) | 11 KB | 1 | ||
13:10, 10 May 2019 | Jr817 NH3BH3 optimisation item table.PNG (file) | 11 KB | 4 | ||
12:23, 10 May 2019 | JR817 P(CH3)4 summary table.PNG (file) | 11 KB | 1 | ||
12:22, 10 May 2019 | JR817 N(CH3)4 summary table.PNG (file) | 11 KB | 1 | ||
23:59, 9 May 2019 | JR817 PCH34 FREQ.LOG (file) | ![]() |
734 KB | 1 | |
23:56, 9 May 2019 | JR817 NCH34 SYMCORRECTED FREQ.LOG (file) | ![]() |
698 KB | 1 | |
23:49, 9 May 2019 | JR817 BH3 MO DIAGRAM.png (file) | ![]() |
193 KB | 8 | |
23:46, 9 May 2019 | JR817 BH3 MO DIAGRAM 2.PNG (file) | 193 KB | 1 | ||
23:21, 9 May 2019 | JR817 NI3 FREQ.LOG (file) | ![]() |
113 KB | 1 | |
23:20, 9 May 2019 | Jr817 NI3 Optimisation summary table.PNG (file) | 11 KB | 1 | ||
01:11, 9 May 2019 | Jr817 NH3 6-21G optimisation item table.PNG (file) | 11 KB | 1 | ||
00:56, 9 May 2019 | JR817 BH3 IR Spectrum.png (file) | ![]() |
15 KB | 2 | |
00:54, 9 May 2019 | JR817 NH3 FREQ.LOG (file) | ![]() |
73 KB | 1 | |
18:45, 8 May 2019 | JR817 BH3 MO E'-2.PNG (file) | 68 KB | 1 | ||
18:45, 8 May 2019 | JR817 BH3 MO A1-2.PNG (file) | 52 KB | 1 | ||
18:44, 8 May 2019 | JR817 BH3 MO A2.PNG (file) | 32 KB | 1 | ||
18:44, 8 May 2019 | JR817 BH3 MO E'-1.PNG (file) | 66 KB | 1 | ||
18:43, 8 May 2019 | BH3 MO e'-1.PNG (file) | 66 KB | 1 | ||
18:42, 8 May 2019 | JR817 BH3 MO A1-1.PNG (file) | 33 KB | 1 | ||
17:53, 7 May 2019 | JR817 BH3 OPT 6-31G.LOG (file) | ![]() |
95 KB | 1 | |
17:47, 7 May 2019 | JR817 BH3 FREQ.LOG (file) | ![]() |
74 KB | 1 | |
17:45, 7 May 2019 | Jr817 BH3 6-31G Item Table.png (file) | ![]() |
11 KB | 2 |