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Uploads by Mtr09

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Date Name Thumbnail Size Description Versions
14:13, 5 December 2011 I2CisImage.mol (file) 847 bytes MOL images and MO diagram 1
14:13, 5 December 2011 I2BridgeImage.mol (file) 843 bytes MOL images and MO diagram 1
14:13, 5 December 2011 BoraneImage.mol (file) 843 bytes MOL images and MO diagram 1
14:13, 5 December 2011 BoraneMOdiagram.png (file) 230 KB MOL images and MO diagram 1
18:39, 1 December 2011 TransMoIRMovie2.gif (file) 668 KB Trans Mol Movie's 1
18:39, 1 December 2011 TransMoIRMovie1.gif (file) 671 KB Trans Mol Movie's 1
18:27, 1 December 2011 TransMovie2.gif (file) 501 KB Movies of both the cis isomers 1
18:27, 1 December 2011 TransMovie1.gif (file) 504 KB Movies of both the cis isomers 1
18:06, 1 December 2011 Optimisation of Molybdenum.png (file) 35 KB Optimisation of Molybdenum 1
09:35, 1 December 2011 Stretch6mtr09.png (file) 12 KB Stretches of TlBr3 1
09:35, 1 December 2011 Stretch5mtr09.png (file) 12 KB Stretches of TlBr3 1
09:35, 1 December 2011 Stretch4mtr09.png (file) 13 KB Stretches of TlBr3 1
09:35, 1 December 2011 Stretch3mtr09.png (file) 10 KB Stretches of TlBr3 1
09:35, 1 December 2011 Stretch2mtr09.png (file) 15 KB Stretches of TlBr3 1
09:35, 1 December 2011 Stretch1mtr09.png (file) 16 KB Stretches of TlBr3 1
00:20, 1 December 2011 IRTlBr3mtr09.png (file) 18 KB IR TlBr3 mtr09 1
21:56, 30 November 2011 TotalEnergyTlBr3.png (file) 14 KB Energy parameter graphs and IR spectra and MOL file of TlBr3 1
21:56, 30 November 2011 RMSGradNormTlBr3.png (file) 18 KB Energy parameter graphs and IR spectra and MOL file of TlBr3 1
21:56, 30 November 2011 TlBr3 optimisationmtr09.mol (file) 434 bytes Energy parameter graphs and IR spectra and MOL file of TlBr3 1
21:56, 30 November 2011 ResultsTlBr3.png (file) 28 KB Energy parameter graphs and IR spectra and MOL file of TlBr3 1
14:38, 30 November 2011 MOBF3.gif (file) 58 KB   2
22:31, 29 November 2011 TransMostructure.mol (file) 2 KB MOL's of both complexes 1
22:31, 29 November 2011 CisMoStructure.mol (file) 2 KB MOL's of both complexes 1
22:22, 29 November 2011 TransMoIRSpec.png (file) 72 KB IR spectra for Cis/Trans Mol complex 1
22:22, 29 November 2011 IRstretchCis.png (file) 74 KB IR spectra for Cis/Trans Mol complex 1
21:06, 29 November 2011 IRstretch45Cis.png (file) 22 KB IR stretches of cis-Molyb. complex 1
21:06, 29 November 2011 IRstretch44Cis.png (file) 23 KB IR stretches of cis-Molyb. complex 1
21:06, 29 November 2011 IRstretch43Cis.png (file) 23 KB IR stretches of cis-Molyb. complex 1
21:06, 29 November 2011 IRstretch42Cis.png (file) 24 KB IR stretches of cis-Molyb. complex 1
21:06, 29 November 2011 IRstretch2Cis.png (file) 23 KB IR stretches of cis-Molyb. complex 1
21:06, 29 November 2011 IRstretch1Cis.png (file) 23 KB IR stretches of cis-Molyb. complex 1
20:12, 29 November 2011 IRstretch45Trans.png (file) 19 KB IR stretch diagrams 1
20:12, 29 November 2011 IRstretch44Trans.png (file) 20 KB IR stretch diagrams 1
20:12, 29 November 2011 IRstretch43Trans.png (file) 20 KB IR stretch diagrams 1
20:12, 29 November 2011 IRstretch42Trans.png (file) 20 KB IR stretch diagrams 1
20:12, 29 November 2011 IRstretch2Trans.png (file) 19 KB IR stretch diagrams 1
20:12, 29 November 2011 IRstretch1Trans.png (file) 18 KB IR stretch diagrams 1
20:10, 29 November 2011 TransResultsSummary.png (file) 11 KB Results summaries for optimisations of the two complexes. 2
20:10, 29 November 2011 TransExtraAnalysisResultsSummary.png (file) 11 KB Results summaries for optimisations of the two complexes. 2
20:10, 29 November 2011 CisResultsSummary.png (file) 10 KB Results summaries for optimisations of the two complexes. 2
20:10, 29 November 2011 CisExtraAnalysisResultsSummary.png (file) 10 KB Results summaries for optimisations of the two complexes. 2
19:07, 28 November 2011 TotalEnergyBH3.png (file) 13 KB Assorted data for BH3 molecule 1
19:07, 28 November 2011 RMSGradNormBH3.png (file) 19 KB Assorted data for BH3 molecule 1
19:07, 28 November 2011 NBOChargeDistBH3.png (file) 13 KB Assorted data for BH3 molecule 1
19:07, 28 November 2011 MOEnergyBH3.png (file) 3 KB Assorted data for BH3 molecule 1
19:04, 28 November 2011 IRspecBH3.png (file) 81 KB IR spec of BH3 4
18:49, 28 November 2011 FrequencyVibBH3.png (file) 39 KB IR spectra of BH3 + modes + molecule in MOL file 1
18:49, 28 November 2011 Frequencyvib6BH3.png (file) 15 KB IR spectra of BH3 + modes + molecule in MOL file 1
18:49, 28 November 2011 Frequencyvib5BH3.png (file) 14 KB IR spectra of BH3 + modes + molecule in MOL file 1
18:49, 28 November 2011 Frequencyvib4BH3.png (file) 15 KB IR spectra of BH3 + modes + molecule in MOL file 1
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