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Uploads by Jg1208

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Date Name Thumbnail Size Description Versions
10:32, 18 February 2012 Jg boat irc jmol.mol (file) 2 KB   1
10:32, 18 February 2012 Jg boat irc gradient curve.PNG (file) 21 KB   1
10:32, 18 February 2012 Jg boat irc opt logfile.out (file) 1.23 MB   1
10:32, 18 February 2012 Jg boat irc laststep summary.PNG (file) 10 KB   1
10:32, 18 February 2012 Jg boat irc movie.gif (file) 210 KB   1
07:38, 18 February 2012 Jg Picture 1aa.png (file) 10 KB   2
07:21, 18 February 2012 Jg ts ir -147.gif (file) 487 KB   1
05:29, 18 February 2012 Jg ethylene am1 HOMO mesh.PNG (file) 124 KB   1
05:29, 18 February 2012 Jg ethylene am1 LUMO mesh.PNG (file) 117 KB   1
05:29, 18 February 2012 Jg cis butadiene am1 LUMO mesh.PNG (file) 108 KB   1
05:29, 18 February 2012 Jg cis butadiene am1 HOMO mesh.PNG (file) 105 KB   1
04:48, 18 February 2012 Jg Picture 2b.png (file) 13 KB   1
03:13, 18 February 2012 Jg chair dft ir 569.gif (file) 1.29 MB   1
03:13, 18 February 2012 Jg chair dft structure.PNG (file) 67 KB   1
03:13, 18 February 2012 Jg chair dft log.out (file) 233 KB   1
03:13, 18 February 2012 Jg chair dft jmol.mol (file) 2 KB   1
03:13, 18 February 2012 Jg chair dft summary.PNG (file) 11 KB   1
02:14, 18 February 2012 Jg hex gauche3 dft output summary.PNG (file) 11 KB   1
02:14, 18 February 2012 Jg dft anti2 opt output summary.PNG (file) 10 KB   1
01:50, 18 February 2012 Jg Picture 6.png (file) 49 KB   1
22:31, 17 February 2012 Jg chair irc method3 log.out (file) 567 KB   1
22:15, 17 February 2012 Jg chair irc method3 movie.gif (file) 579 KB   1
22:15, 17 February 2012 Jg chair irc method3 laststep summary.PNG (file) 11 KB   1
22:15, 17 February 2012 Jg chair irc method3 gradient curve.PNG (file) 22 KB   1
22:15, 17 February 2012 Jg chair irc method3 laststep.PNG (file) 33 KB   1
22:15, 17 February 2012 Jg chair irc method3 firststep.PNG (file) 30 KB   1
22:15, 17 February 2012 Jg chair irc method3 energy curve.PNG (file) 18 KB   1
21:25, 17 February 2012 Jg chair irc method2 laststep.PNG (file) 23 KB   1
21:25, 17 February 2012 Jg chair irc method2 firststep.PNG (file) 28 KB   1
21:25, 17 February 2012 Jg chair irc method2 energy curve.PNG (file) 16 KB   1
21:25, 17 February 2012 Jg chair irc method2 gradient curve.PNG (file) 20 KB   1
21:25, 17 February 2012 Jg chair irc method2 laststep summary.PNG (file) 11 KB   1
21:25, 17 February 2012 Jg chair irc method2 jmol.mol (file) 2 KB   1
21:25, 17 February 2012 Jg chair irc method2 log.out (file) 567 KB   1
21:25, 17 February 2012 Jg chair irc method2 movie.gif (file) 436 KB   1
21:03, 17 February 2012 Jg)Picture 5.png (file) 19 KB   1
20:39, 17 February 2012 Jg chair method1 gradient curve.PNG (file) 22 KB   1
20:39, 17 February 2012 Jg chair method1 energy curve.PNG (file) 17 KB   1
20:39, 17 February 2012 Jg chair method1 movie.gif (file) 112 KB   1
20:39, 17 February 2012 Jg chair method1 log.out (file) 235 KB   1
20:39, 17 February 2012 Jg chair method1 jmol.mol (file) 2 KB   1
20:39, 17 February 2012 Jg chair method1 structure.PNG (file) 24 KB   1
20:39, 17 February 2012 Jg chair method1 summary.PNG (file) 11 KB   1
20:24, 17 February 2012 Jg chair irc energy curve.PNG (file) 16 KB   1
20:16, 17 February 2012 Jg chair irc log.out (file) 535 KB   1
20:16, 17 February 2012 Jg chair irc laststep.PNG (file) 37 KB   1
20:16, 17 February 2012 Jg chair irc gradient curve.PNG (file) 17 KB   1
20:16, 17 February 2012 Jg chair irc firststep.PNG (file) 43 KB   1
20:16, 17 February 2012 Jg chair irc movie.gif (file) 355 KB   1
20:16, 17 February 2012 Jg chair irc laststep summary.PNG (file) 10 KB   1
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