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Date Name Thumbnail Size Description Versions
12:18, 16 March 2009 Presentation2.ppt (file) 101 KB   1
17:42, 13 March 2009 Login cluster.jpg (file) 82 KB   1
09:43, 12 March 2009 Courbe rc.jpg (file) 13 KB   1
14:21, 11 March 2009 Ci explanation triple.jpg (file) 66 KB   2
16:24, 5 March 2009 Opt qst2 mol.jpg (file) 54 KB   2
15:38, 5 March 2009 Opt qst3 singulet.jpg (file) 69 KB   1
17:12, 4 March 2009 Mol triplet.jpg (file) 8 KB   1
17:11, 4 March 2009 Mol singulet.jpg (file) 8 KB   1
16:57, 4 March 2009 Aurelie opt tsberny calcall dftuccpvdz singulet end1.log (file) 100 KB   1
16:57, 4 March 2009 Aurelie opt tsberny calcall dftuccpvdz triplet.log (file) 178 KB   1
16:57, 4 March 2009 Aurelie opt min calcall dftccpvdz cyclopropane.log (file) 69 KB   1
16:56, 4 March 2009 Aurelie opt min calcall dftccpvdz propene.log (file) 133 KB   1
10:53, 4 March 2009 Irc 20step tsberny singulet.jpg (file) 87 KB   1
10:46, 4 March 2009 Opt tsberny singulet.jpg (file) 93 KB   1
10:28, 4 March 2009 Opt tsberny triplet.jpg (file) 92 KB   1
15:14, 2 March 2009 Irc saut proton singulet.jpg (file) 92 KB   1
15:07, 2 March 2009 Irc 27step singulet.jpg (file) 89 KB   1
12:04, 2 March 2009 Triplet anim freq.jpg (file) 110 KB   1
17:36, 27 February 2009 Aurelie opt+freq dft2 propene.log (file) 115 KB   1
17:23, 27 February 2009 I got this output.log (file) 133 KB   1
16:30, 27 February 2009 Aurelie opt+freq dft2 distort propene.log (file) 163 KB   1
09:18, 26 February 2009 25 02.jpg (file) 10 KB   1
09:18, 26 February 2009 Essai paint2.jpg (file) 10 KB   3
16:34, 24 February 2009 Mol3 mm gaussian.jpg (file) 20 KB   1
16:30, 24 February 2009 Mol2 mm gaussian.jpg (file) 16 KB   1
16:29, 24 February 2009 Mol1 mm gaussian.jpg (file) 10 KB   2
14:49, 24 February 2009 Propene labels.jpg (file) 16 KB   1
15:23, 20 February 2009 Change angle.jpg (file) 17 KB Change the angle 1
15:23, 20 February 2009 Distortion of CH3.jpg (file) 15 KB Rotate the CH3 groupe 1
11:47, 18 February 2009 Anim TS1 zoom.jpg (file) 37 KB   1
11:47, 18 February 2009 Anim TS1.jpg (file) 112 KB   1
11:37, 18 February 2009 TS1.jpg (file) 13 KB   2
14:38, 17 February 2009 Prop+cyclo.jpg (file) 16 KB   1
12:50, 17 February 2009 Animated freq.jpg (file) 116 KB   1
11:56, 17 February 2009 Surface energie mieux.jpg (file) 102 KB   1
09:51, 16 February 2009 Spectrum C cyclopropane.jpg (file) 67 KB   1
09:50, 16 February 2009 Spectrum C propene.jpg (file) 71 KB   3
09:49, 16 February 2009 Spectrum H cyclopropane.jpg (file) 77 KB   1
09:23, 16 February 2009 Spectrum H propene.jpeg (file) 62 KB NMR spectrum of propene obtain with DFT (6-21G) 2
18:04, 13 February 2009 Spectrum H propene.tiff (file) 111 KB   1
11:11, 13 February 2009 Tableenergy.png (file) 23 KB   1
11:01, 13 February 2009 Enwork.xml (file) 7 KB   1
10:55, 13 February 2009 Ener.png (file) 19 KB   1
10:17, 13 February 2009 Workbook1.xml (file) 7 KB   1
16:25, 12 February 2009 Propene+cyclopropane.jpg (file) 11 KB   1
15:40, 12 February 2009 Propene1.jpg (file) 12 KB   1
15:40, 12 February 2009 Propene2.jpg (file) 11 KB   1
15:37, 12 February 2009 Cyclo.jpg (file) 10 KB   1
15:36, 12 February 2009 Cyclopropane.jpg (file) 5 KB   1
15:16, 12 February 2009 Propene.jpg (file) 61 KB These is the propene 1
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