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13:46, 20 May 2020
Dist vs time2.png
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13 KB
Jz14418
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Distance against time plot for transition state
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13:41, 20 May 2020
Optimisation1 01508310.png
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55 KB
Hh2218
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13:37, 20 May 2020
H2 AB BC displaced TS momenta dpc18.png
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177 KB
Dpc18
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13:36, 20 May 2020
Hw7018-E1-internuclear distance vs t.png
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34 KB
Hw7018
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13:35, 20 May 2020
Internucleardistance 01508310.png
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14 KB
Hh2218
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13:17, 20 May 2020
Bl2518q3mep.png
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26 KB
Bl2518
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13:16, 20 May 2020
Bl2518dynamics.png
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28 KB
Bl2518
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13:14, 20 May 2020
Bl251893mepcontour.png
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157 KB
Bl2518
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13:11, 20 May 2020
Bl2518q3dynamicscontour.png
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157 KB
Bl2518
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13:09, 20 May 2020
Animation101508310.png
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10 KB
Hh2218
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12:31, 20 May 2020
H2 displaced TS contour combined dpc18.png
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1.2 MB
Dpc18
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12:26, 20 May 2020
H2 AB BC displaced TS int nuc dist dpc18.png
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121 KB
Dpc18
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12:23, 20 May 2020
Screen Shot 2020-05-20 at 13.23.13.png
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42 KB
Aec18
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12:18, 20 May 2020
Momenta time MEP H2.png
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12 KB
Yy11518
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12:17, 20 May 2020
Momenta time dynamics H2.png
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33 KB
Yy11518
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12:17, 20 May 2020
Distance time MEP H2.png
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24 KB
Yy11518
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12:16, 20 May 2020
Distance time dynamics H2.png
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28 KB
Yy11518
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12:03, 20 May 2020
Q7 xs2218.png
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102 KB
Xs2218
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12:00, 20 May 2020
MEP H2.png
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147 KB
Yy11518
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12:00, 20 May 2020
Dynamics H2.png
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148 KB
Yy11518
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11:56, 20 May 2020
Bl2518q2contour.png
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156 KB
Bl2518
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11:54, 20 May 2020
Q1 xs2218.png
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150 KB
Xs2218
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11:50, 20 May 2020
H2 displaced TS contour MEP dpc18.png
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161 KB
Dpc18
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11:46, 20 May 2020
Bl2518q2main.png
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13 KB
Bl2518
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11:36, 20 May 2020
Screenshot 2020-05-20 at 12.34.22.png
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418 KB
Jk718
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11:35, 20 May 2020
Screenshot 2020-05-20 at 12.33.41.png
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497 KB
Jk718
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11:15, 20 May 2020
Screenshot 2020-05-20 at 12.14.44.png
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773 KB
Jk718
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11:08, 20 May 2020
4aadatapazp2518.png
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43 KB
Zp2518
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11:03, 20 May 2020
Screenshot 2020-05-20 at 12.03.28.png
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788 KB
Jk718
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10:59, 20 May 2020
Screenshot 2020-05-20 at 6.57.44 PM.png
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309 KB
Jz14418
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Identification of transition state
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10:56, 20 May 2020
Screenshot 2020-05-20 at 11.55.51.png
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775 KB
Jk718
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10:50, 20 May 2020
Screenshot 2020-05-20 at 11.50.32.png
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771 KB
Jk718
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10:40, 20 May 2020
Screenshot 2020-05-20 at 11.40.27.png
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787 KB
Jk718
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1
10:30, 20 May 2020
H2 TS Bond Distance vs Time dpc18.png
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13 KB
Dpc18
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1
10:06, 20 May 2020
H2 initial int nuc dist dpc18.png
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34 KB
Dpc18
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DPC18
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09:55, 20 May 2020
3aTSazp2518.png
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257 KB
Zp2518
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2
09:32, 20 May 2020
ZN 01510257 Q4 Figure 5.png
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182 KB
Zn4318
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Surface plot of the 5th trajectory as shown in the table.
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09:32, 20 May 2020
10.6 01532430.png
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156 KB
Aa23918
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09:32, 20 May 2020
10.1 01532430.png
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155 KB
Aa23918
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09:31, 20 May 2020
3.1 01532430.png
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153 KB
Aa23918
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09:31, 20 May 2020
3.1 2 01532430.png
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154 KB
Aa23918
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09:30, 20 May 2020
2.56 01532430.png
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159 KB
Aa23918
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jkk
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09:29, 20 May 2020
ZN 01510257 Q4 Figure 3.png
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179 KB
Zn4318
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Surface plot of the 3rd trajectory stated in the table.
1
09:26, 20 May 2020
ZN 01510257 Q4 Figure 2.png
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180 KB
Zn4318
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Surface plot of the seconds stated trajectory showin in table.
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08:58, 20 May 2020
1.4 MOM 01532430.png
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35 KB
Aa23918
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1
08:58, 20 May 2020
1.4 INT 01532430.png
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28 KB
Aa23918
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08:57, 20 May 2020
1.4 01532430.png
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158 KB
Aa23918
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08:21, 20 May 2020
Internucleardistance vs time TS H+H2 01516896.png
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13 KB
Rp318
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07:59, 20 May 2020
2asurfaceplotazp2518.png
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150 KB
Zp2518
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07:27, 20 May 2020
1amolabcazp2518.png
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71 KB
Zp2518
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1
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