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Date Name Thumbnail Size Description Versions
14:36, 15 February 2009 FluorobenzenecomplexEXPIRGU.pdf (file) 179 KB   1
14:35, 15 February 2009 ChlorobenzeneComplexExpIRGU.pdf (file) 114 KB   1
14:35, 15 February 2009 AnisolecomplexEXPIRGU.pdf (file) 162 KB   1
12:27, 15 February 2009 FluorobenzenecomplexB3LYPandLANL2DZoptimizedGU.out (file) 255 KB   1
12:27, 15 February 2009 FluorobenzenecomplexB3LYPandLANL2MBoptimizedGU.out (file) 578 KB   1
12:26, 15 February 2009 ChlorobenzenecomplexB3LYPandLANL2DZoptimizedGU.out (file) 279 KB   1
12:26, 15 February 2009 ChlorobenzenecomplexB3LYPandLANL2MBoptimizedGU.out (file) 305 KB   1
12:25, 15 February 2009 AnisolecomplexB3LYPandLANL2DZoptimizedGU.out (file) 709 KB   1
12:25, 15 February 2009 AnisolecomplexB3LYPandLANL2MBoptimizedGU.out (file) 526 KB   1
12:19, 15 February 2009 ErrormessageGU.jpg (file) 66 KB   1
12:12, 15 February 2009 OptimizedfluorobenzenecomplexGU.mol (file) 2 KB   2
18:58, 14 February 2009 LabelledfluorobenzenecomplexGU.jpg (file) 88 KB   1
18:58, 14 February 2009 LabelledchlorobenzenecomplexGU.jpg (file) 89 KB   1
18:58, 14 February 2009 LabelledanisolecomplexGU.jpg (file) 90 KB   1
18:57, 14 February 2009 LUMOcomplexAGU.jpg (file) 50 KB   1
18:57, 14 February 2009 LUMO+1complexAGU.jpg (file) 54 KB   1
18:57, 14 February 2009 HOMOcomplexAGU.jpg (file) 52 KB   1
18:57, 14 February 2009 HOMO-1GUcomplexA.jpg (file) 53 KB   1
18:56, 14 February 2009 ComplexCelectrondensityGU.jpg (file) 21 KB   1
18:56, 14 February 2009 ComplexBelectrondensityGU.jpg (file) 28 KB   1
18:56, 14 February 2009 ComplexAelectrondensityGU.jpg (file) 27 KB   1
18:56, 14 February 2009 FluorobenzenecomplexIRGU.jpg (file) 203 KB   1
18:56, 14 February 2009 ComplexCtableIRGU.jpg (file) 43 KB   2
18:53, 14 February 2009 ComplexBtableGU.jpg (file) 105 KB   1
18:53, 14 February 2009 ComplexAtableGU.jpg (file) 100 KB   1
18:53, 14 February 2009 ChlorobenzenecomplexIRGU.jpg (file) 209 KB   1
18:53, 14 February 2009 AnisolecomplexIRGU.jpg (file) 235 KB   1
18:52, 14 February 2009 OptimizedchlorobenzenecomplexGU.mol (file) 2 KB   1
18:52, 14 February 2009 OptimizedanisolecomplexGU.mol (file) 2 KB   1
18:51, 14 February 2009 ReactionschemesGU.jpg (file) 81 KB   1
18:51, 14 February 2009 FluorobenzenesummaryGU.jpg (file) 79 KB   1
18:51, 14 February 2009 FluorobenzenecomplexsummaryGU.jpg (file) 81 KB   1
18:51, 14 February 2009 Crhexacarbonylsummary.jpg (file) 77 KB   1
18:50, 14 February 2009 COoptimizationsummaryGU.jpg (file) 73 KB   1
18:50, 14 February 2009 ChlorobenzenesummaryGU.jpg (file) 73 KB   1
18:50, 14 February 2009 ChlorobenzenecomplexsummaryGU.jpg (file) 77 KB   1
18:50, 14 February 2009 AnisolesummaryGU.jpg (file) 73 KB   1
18:50, 14 February 2009 AnisolecomplexsummaryGU.jpg (file) 75 KB   1
15:26, 14 February 2009 D3hammoniaIRGU.LOG (file) 25 KB   1
15:25, 14 February 2009 C3vammoniaIRGU.LOG (file) 24 KB   1
15:04, 14 February 2009 D3hfrequenciesGU.jpg (file) 34 KB   1
14:33, 14 February 2009 NH3optimizedD3Husing6311gdpGU.LOG (file) 42 KB   1
14:33, 14 February 2009 NH3OPTIMIZED6311GdpC3vGU.LOG (file) 57 KB   1
14:19, 14 February 2009 OPTIMIZEDNH3C3VGU.LOG (file) 56 KB   1
14:19, 14 February 2009 OPTIMIZEDNH3D3HGU.LOG (file) 35 KB   1
14:18, 14 February 2009 OPTIMIZEDNH3C1GU.LOG (file) 53 KB   1
14:17, 14 February 2009 IRd3hGU.jpg (file) 208 KB   1
14:17, 14 February 2009 IRcomparisonliteraturetableGU.jpg (file) 61 KB   1
14:17, 14 February 2009 IRC3vGU.jpg (file) 177 KB   1
14:17, 14 February 2009 D3hfrequencies.jpg (file) 34 KB   1
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