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Uploads by Ir208

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Date Name Thumbnail Size Description Versions
13:06, 18 February 2011 IRspectrumCianti2631GdDFT.JPG (file) 50 KB   1
13:01, 18 February 2011 BGAUCHEREACTANTOPTI631D.LOG (file) 139 KB   2
13:00, 18 February 2011 CIANTIOPTI631DDFT.LOG (file) 108 KB   1
12:55, 18 February 2011 Anti1picturee.JPG (file) 14 KB   1
12:53, 18 February 2011 Anti3picture.jpg (file) 14 KB   2
12:50, 18 February 2011 Anti4picture.jpg (file) 13 KB   2
12:39, 18 February 2011 Cianti2631labelled.JPG (file) 17 KB   1
12:37, 18 February 2011 Anti1picture.jpg (file) 2 KB   1
12:33, 18 February 2011 Cgauche6picture.jpg (file) 9 KB   1
12:28, 18 February 2011 Cgauche5picture.JPG (file) 14 KB   1
12:26, 18 February 2011 Cgauche4picture.JPG (file) 13 KB   1
12:25, 18 February 2011 Cgauche2picture.JPG (file) 13 KB   1
12:23, 18 February 2011 Cgauche1picture.JPG (file) 14 KB   1
12:21, 18 February 2011 Bgauche3optilabelled.JPG (file) 18 KB   1
15:29, 9 February 2011 Siloxane frequency .out (file) 1.87 MB   1
15:27, 9 February 2011 Silosulfurfreq.out (file) 200 KB   1
15:26, 9 February 2011 Nboanalysissi-s bond.JPG (file) 75 KB   1
15:26, 9 February 2011 Nbocolours.JPG (file) 42 KB   1
15:25, 9 February 2011 NboanalysisSi-obond.JPG (file) 65 KB   1
15:24, 9 February 2011 NBO Charge Analysis.JPG (file) 34 KB   1
15:23, 9 February 2011 IRgermansulfur.JPG (file) 61 KB   1
15:22, 9 February 2011 IRsilosulfur.JPG (file) 59 KB   1
15:21, 9 February 2011 IR Spectrum of siloxane.JPG (file) 57 KB   1
15:20, 9 February 2011 Thiane vibs plus lit.JPG (file) 56 KB   1
15:20, 9 February 2011 Oxane vibs with lit.JPG (file) 59 KB   1
15:19, 9 February 2011 Optimisation resultable.JPG (file) 52 KB   1
15:18, 9 February 2011 Germansulfuropt2.out (file) 591 KB   1
15:17, 9 February 2011 Germanoxaneopt2.out (file) 270 KB   1
15:16, 9 February 2011 Siloxsulfuropt2.out (file) 397 KB   1
15:15, 9 February 2011 Siloxaneopt2.out (file) 272 KB   1
15:14, 9 February 2011 German sulfur opt2.JPG (file) 37 KB   1
15:13, 9 February 2011 Germanoeoxaneopt2.JPG (file) 30 KB   1
15:12, 9 February 2011 Siloxsulfuropt2summary.JPG (file) 34 KB   1
15:11, 9 February 2011 Siloxaneopt2andnbosummary.JPG (file) 31 KB   1
16:51, 8 February 2011 Parameters cis trans.JPG (file) 39 KB   1
16:49, 8 February 2011 Cisopt2adv.out (file) 155 KB   1
16:37, 8 February 2011 Trans carbonyl vibrations.JPG (file) 36 KB   1
16:27, 8 February 2011 Cis vibs.JPG (file) 57 KB   1
16:06, 8 February 2011 Isomerisation dissoss one.JPG (file) 22 KB   1
16:04, 8 February 2011 Isomerisation baillar twist.JPG (file) 23 KB   1
16:03, 8 February 2011 Trans symmetry.JPG (file) 37 KB   1
16:02, 8 February 2011 Cis symmetry.JPG (file) 32 KB   1
16:01, 8 February 2011 Cis trans rotation.JPG (file) 43 KB   1
16:00, 8 February 2011 Lit ref co stretch.JPG (file) 39 KB   1
15:09, 8 February 2011 Tlbr3frequency.out (file) 29 KB   1
15:08, 8 February 2011 IR tlBr3.JPG (file) 53 KB   1
15:06, 8 February 2011 Low frequencies tlbr3.JPG (file) 88 KB   1
15:03, 8 February 2011 Results tlbr3.JPG (file) 28 KB   1
14:57, 8 February 2011 Tlbr3optimisationsummary.JPG (file) 31 KB   2
14:54, 8 February 2011 Tlbr3 vibs.JPG (file) 44 KB   1
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