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18:51, 5 December 2011 Btl09 talk contribs uploaded File:IR stretch 1.jpg
18:49, 5 December 2011 Btl09 talk contribs uploaded File:Tlbr3IR spectrum.jpg
18:41, 5 December 2011 Btl09 talk contribs uploaded File:TLBR3 OPTIMISATION.mol2
17:44, 5 December 2011 Btl09 talk contribs uploaded File:Second Order Perturbation Theory Analysis of Fock Matrix in NBO Basis.PNG
17:44, 5 December 2011 Btl09 talk contribs uploaded File:NBO charges.PNG
17:44, 5 December 2011 Btl09 talk contribs uploaded File:Natural Bond Orbitals (summary).PNG
17:44, 5 December 2011 Btl09 talk contribs uploaded File:Bond Orbital Coefficient Hybrids.PNG
17:35, 5 December 2011 Btl09 talk contribs uploaded File:NBO colour by charge.jpg
17:00, 5 December 2011 Btl09 talk contribs uploaded File:LCAO8.png
17:00, 5 December 2011 Btl09 talk contribs uploaded File:LCAO7.png
17:00, 5 December 2011 Btl09 talk contribs uploaded File:LCAO6.png
17:00, 5 December 2011 Btl09 talk contribs uploaded File:LCAO5.png
17:00, 5 December 2011 Btl09 talk contribs uploaded File:LCAO4.png
17:00, 5 December 2011 Btl09 talk contribs uploaded File:LCAO3.png
17:00, 5 December 2011 Btl09 talk contribs uploaded File:LCAO2.png
17:00, 5 December 2011 Btl09 talk contribs uploaded File:LCAO1.png
16:43, 5 December 2011 Btl09 talk contribs uploaded a new version of File:MO8.jpg
16:43, 5 December 2011 Btl09 talk contribs uploaded File:MO7.jpg
16:43, 5 December 2011 Btl09 talk contribs uploaded a new version of File:MO6.jpg
16:43, 5 December 2011 Btl09 talk contribs uploaded a new version of File:MO5.jpg
16:43, 5 December 2011 Btl09 talk contribs uploaded a new version of File:MO4.jpg
16:43, 5 December 2011 Btl09 talk contribs uploaded a new version of File:MO3.jpg
16:43, 5 December 2011 Btl09 talk contribs uploaded a new version of File:MO2.jpg
16:43, 5 December 2011 Btl09 talk contribs uploaded a new version of File:MO1.jpg
16:01, 5 December 2011 Btl09 talk contribs uploaded File:Btl09MO diagram.PNG
15:59, 5 December 2011 Btl09 talk contribs uploaded a new version of File:BH3 MO.gif
14:31, 5 December 2011 Btl09 talk contribs uploaded File:BH3 low frequencies.PNG
13:45, 5 December 2011 Btl09 talk contribs uploaded File:BH3IR6.PNG
13:45, 5 December 2011 Btl09 talk contribs uploaded File:BH3IR5.PNG
13:45, 5 December 2011 Btl09 talk contribs uploaded File:BH3IR4.PNG
13:45, 5 December 2011 Btl09 talk contribs uploaded File:BH3IR3.PNG
13:45, 5 December 2011 Btl09 talk contribs uploaded File:BH3IR2.PNG
13:45, 5 December 2011 Btl09 talk contribs uploaded File:BH3IR1.PNG
13:28, 5 December 2011 Btl09 talk contribs uploaded a new version of File:BH3 IR Spectrum.jpg
11:45, 5 December 2011 Btl09 talk contribs uploaded File:BH3 opt stage 4.jpg
11:45, 5 December 2011 Btl09 talk contribs uploaded File:BH3 opt stage 3.jpg
11:45, 5 December 2011 Btl09 talk contribs uploaded File:BH3 opt stage 2.jpg
11:45, 5 December 2011 Btl09 talk contribs uploaded File:BH3 opt stage 1.jpg
11:37, 5 December 2011 Btl09 talk contribs uploaded File:BH3 opt.mng
11:34, 5 December 2011 Btl09 talk contribs uploaded File:BH3 opt plot gradient.jpg
11:33, 5 December 2011 Btl09 talk contribs uploaded File:BH3 opt plot.jpg
11:24, 5 December 2011 Btl09 talk contribs uploaded File:Optimisation confirmation.PNG
23:44, 4 December 2011 Btl09 talk contribs uploaded File:Btl09BH3 OPT.mol
12:51, 25 November 2011 Btl09 talk contribs uploaded File:Btl091DFT12.mol
12:50, 25 November 2011 Btl09 talk contribs uploaded File:Btl091DFT11.mol
12:42, 25 November 2011 Btl09 talk contribs uploaded File:DFT12NMRN.jpg
12:36, 25 November 2011 Btl09 talk contribs uploaded File:DFT12IR.jpg
12:24, 25 November 2011 Btl09 talk contribs uploaded File:DFT11IR.jpg
12:00, 25 November 2011 Btl09 talk contribs uploaded a new version of File:DFT12NMR.jpg
11:59, 25 November 2011 Btl09 talk contribs uploaded File:DFT11NMRN.jpg