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14:20, 10 May 2018
MS6216 Benzene low frequencies.PNG
(
file
)
3 KB
1
14:18, 10 May 2018
MS6216 BENZENE 6-31G D6H FREQ.LOG
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file
)
565 KB
1
14:17, 10 May 2018
MS6216 BENZENE 6-31G D6H freq.gjf
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file
)
1 KB
1
14:14, 10 May 2018
MS6216 benzene item table.PNG
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file
)
5 KB
1
14:13, 10 May 2018
MS6216 Benzene summary table.PNG
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file
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11 KB
1
13:11, 10 May 2018
MS6216 BBr3 freq2.log
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file
)
36 KB
1
13:10, 10 May 2018
MS6216 BBr3 frequency table.PNG
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file
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3 KB
1
12:26, 10 May 2018
MS6216 BBr3 item table.PNG
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file
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5 KB
1
12:25, 10 May 2018
MS6216 BBr3 summary table.PNG
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file
)
10 KB
1
12:04, 10 May 2018
MS6216 ADDUCT 6-31G FREQUENCY.LOG
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file
)
182 KB
1
12:03, 10 May 2018
MS6216 adduct frequency.PNG
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file
)
3 KB
1
11:57, 10 May 2018
MS6216 adduct summary table.PNG
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file
)
5 KB
1
11:55, 10 May 2018
MS6216 adduct item table.PNG
(
file
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10 KB
1
11:52, 10 May 2018
MS6216 itemtable.PNG
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file
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8 KB
1
11:51, 10 May 2018
MS6216 summarytable.PNG
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file
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11 KB
1
11:48, 10 May 2018
MS6216 NH3 OPTIMISATION 6-31G FREQUENCYANALYSIS.LOG
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file
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73 KB
1
11:39, 10 May 2018
MS6216 NH3 lowfrequencies.PNG
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file
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3 KB
1
11:37, 10 May 2018
MS6216 NH3itemtable.PNG
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file
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8 KB
1
11:34, 10 May 2018
MS6216 BH3itemtable.PNG
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file
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8 KB
1
11:32, 10 May 2018
MS6216 optimisedNH3summarytable.PNG
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file
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11 KB
1
11:18, 10 May 2018
MS6216 BH3 SYM OPT D3H SYMMETRY FREQUENCY.LOG
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file
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73 KB
1
11:16, 10 May 2018
MS6216 optimisedsummarytable.PNG
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file
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12 KB
1
16:55, 8 May 2018
MS6216 MOdiagram2.PNG
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file
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77 KB
1
16:54, 8 May 2018
MS6216 MOdiagram withpictures.PNG
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file
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77 KB
1
16:47, 8 May 2018
MS6216 BH3 MO Diagram.PNG
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file
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34 KB
1
16:32, 8 May 2018
MS6216 irspectrum.PNG
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file
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14 KB
1
15:51, 8 May 2018
MS6216 BH3 OPTIMISATION NEW OPTIMISATION 6-31G.LOG
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file
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21 KB
1
15:35, 8 May 2018
MS6216 Summary BH3 Summarytable.PNG
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file
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37 KB
1
11:26, 3 March 2017
MS6216 Fluorine Sigma(bonding)2s.PNG(2).PNG
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file
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113 KB
1
10:51, 3 March 2017
MS6216 Fluorine Sigma(antibonding)2s.PNG
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file
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131 KB
1
10:49, 3 March 2017
MS6216 Fluorine Sigma(bonding)2s.PNG
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file
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70 KB
1
09:59, 3 March 2017
MS6216 Ammonia IR.PNG
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file
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28 KB
1
12:26, 2 March 2017
MS6216 Fluorine Pi(antibonding)2py..PNG
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file
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286 KB
2
12:22, 2 March 2017
MS6216 Fluorine Pi(antibonding)2px.PNG
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file
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256 KB
1
12:22, 2 March 2017
MS6216 Fluorine Pi(bonding)2px.PNG
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file
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257 KB
1
12:22, 2 March 2017
MS6216 Fluorine Pi(bonding)2py.PNG
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file
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260 KB
1
12:22, 2 March 2017
MS6216 Fluorine Sigma(bonding)2pz.PNG
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file
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254 KB
1
11:47, 2 March 2017
MS6216 Fluorine Charges.PNG
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file
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75 KB
1
11:44, 2 March 2017
MS6216 Display Vibrations Fluorine.PNG
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file
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2 KB
1
11:41, 2 March 2017
MATTSMITH FLUORINE OPTIMIZATION.LOG
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file
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205 KB
1
11:33, 2 March 2017
MS6216 Hydrogen Charges.PNG
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file
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51 KB
1
11:33, 2 March 2017
MS6216 Nitrogen Charges.PNG
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file
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58 KB
1
11:08, 2 March 2017
MS6216 Ammonia Charges.PNG
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file
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45 KB
1
10:25, 2 March 2017
MS6216 Display Vibrations Hydrogen.PNG
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file
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3 KB
1
10:24, 2 March 2017
MATTSMITH HYDROGEN OPTF POP.LOG
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file
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96 KB
1
10:15, 2 March 2017
MS6216 Display Vibrations Nitrogen.PNG
(
file
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4 KB
1
10:09, 2 March 2017
MattSmith Nitrogen optf pop.gjf
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file
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367 bytes
1
10:06, 2 March 2017
MATTSMITH NITROGEN OPTF POP.LOG
(
file
)
196 KB
1
11:14, 27 February 2017
MATTSMITH NH3 OPTF POP.LOG
(
file
)
228 KB
1
11:14, 27 February 2017
MattSmith NH3 optf pop.gjf
(
file
)
497 bytes
2
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