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Uploads by Nk2413

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Date Name Thumbnail Size Description Versions
11:48, 26 January 2016 DIELS ALDER TS BUTADIENE ETHENE.LOG (file) 756 KB   1
11:46, 26 January 2016 NK OPT DA LUMO.png (file) 207 KB   1
11:33, 26 January 2016 NK OPT DA HOMO.png (file) 117 KB   1
11:29, 26 January 2016 NK DA ET BU RESULTS TABLE.png (file) 19 KB   1
10:55, 26 January 2016 NK OPT BUTADIENE LUMO.png (file) 215 KB   1
10:54, 26 January 2016 NK OPT BUTADIENE HOMO.png (file) 194 KB   1
10:54, 26 January 2016 NK OPT ETHENE LUMO.png (file) 227 KB   1
10:53, 26 January 2016 NK OPT ETHENE HOMO.png (file) 218 KB   1
10:17, 26 January 2016 NK OPT CIS BUTADIENE.LOG (file) 89 KB   1
10:17, 26 January 2016 NK OPT ETHENE.LOG (file) 71 KB   1
10:15, 26 January 2016 OPT ETHENE.LOG (file) 71 KB   2
10:14, 26 January 2016 NK OPT ETHENE RESULTS TABLE.png (file) 19 KB   1
10:14, 26 January 2016 NK OPT BUTADIENE RESULTS TABLE.png (file) 20 KB   1
17:14, 25 January 2016 BOAT REOPTIMISATION BLY3P 631GD.LOG (file) 216 KB   1
17:07, 25 January 2016 NK BOAT 6 31GD OPT.png (file) 22 KB   1
16:45, 25 January 2016 NK CHAIR FC 6 31GD OPT.png (file) 22 KB   1
16:43, 25 January 2016 REOPTIMISE BYLP 631GD TSBERNY FC.LOG (file) 211 KB   1
16:03, 25 January 2016 OPTIMISING IRC GEOMETRY43.LOG (file) 140 KB   1
15:58, 25 January 2016 NK IRC REOPTIMISATION RESULTS TABLE.png (file) 20 KB   1
15:07, 25 January 2016 NK IRC CALCULATION RESULTS.png (file) 55 KB   1
13:06, 25 January 2016 NK ANTI2 NUMBERED PARTE CONVERGE TO BOAT.LOG (file) 617 KB   1
13:05, 25 January 2016 NK SUCCESS BOATTS RESULTS TABLE.png (file) 22 KB   1
12:03, 25 January 2016 NK SUCCESS BOAT PRODUCT.png (file) 124 KB   1
12:02, 25 January 2016 NK SUCCESS BOAT REACTANT.png (file) 122 KB   1
11:37, 25 January 2016 NK FAILED BOAT TS.png (file) 107 KB   1
11:07, 25 January 2016 NK ANTI2 BOAT OPT PRODUCT.png (file) 119 KB   1
11:06, 25 January 2016 NK ANTI2 BOAT OPT REACTANT.png (file) 116 KB   1
20:18, 24 January 2016 NK FROZEN CO-ORDINATE OPTIMISATION RESULTS TABLE.png (file) 22 KB   1
20:15, 24 January 2016 NK FROZEN COORDINATE OPTIMISE TSBERNY PARTD.LOG (file) 252 KB   1
19:23, 24 January 2016 NK OPTIMISE TS BERNY.LOG (file) 316 KB   1
19:13, 24 January 2016 NK IMAG VIBRATION ANIMATION COPE TS BERNY.gif (file) 4.66 MB   1
17:52, 24 January 2016 NK ALLYL FRAGEMENT RESULTS TABLE SUMMARY.png (file) 19 KB   1
17:50, 24 January 2016 NK ALLYL FRAGMENT.LOG (file) 74 KB   1
14:16, 24 January 2016 NK ANTI2 FREQ ANALYSIS RESULTS TABLE.png (file) 21 KB   1
14:15, 24 January 2016 NK ANTI2 FREQ ANALYSIS IR SPECTRUM.png (file) 22 KB   1
13:56, 24 January 2016 NK ANTI2 HF 3 21G ATOMS LABELLED.png (file) 111 KB   1
13:55, 24 January 2016 NK ANTI2 6 31G D ATOMS LABELLED.png (file) 108 KB   1
11:35, 24 January 2016 NK HOMO GAUCHE3 CYCLOHEXADIENE.png (file) 302 KB   1
11:34, 24 January 2016 NK HOMO ANTI2 CYCLOHEXADIENE.png (file) 268 KB   1
18:57, 22 January 2016 NK2413 REACT ANTI2 RESULTS TABLE 631GD DFT.png (file) 19 KB   1
18:49, 22 January 2016 NK2413 REACT ANTI2 6 31GD DFT.LOG (file) 144 KB   1
17:56, 22 January 2016 REACT GAUCHE5 RESULTS TABLE.png (file) 18 KB   1
17:55, 22 January 2016 NK2413 REACT GAUCHE3 RESULTS TABLE.png (file) 18 KB   1
17:54, 22 January 2016 NK2413 REACT ANTI4 RESULTS TABLE.png (file) 18 KB   1
17:53, 22 January 2016 NK REACT ANTI2 RESULTS TABLE.png (file) 18 KB   1
17:50, 22 January 2016 NK2413 REACT ANTI2.png (file) 18 KB   1
17:16, 22 January 2016 NK2413 REACT GAUCHE5.LOG (file) 184 KB   1
17:12, 22 January 2016 NK2413 REACT GAUCHE3.LOG (file) 151 KB   1
17:09, 22 January 2016 NK2413 REACT ANTI4.LOG (file) 184 KB   1
17:00, 22 January 2016 NK2413 REACT ANTI2.LOG (file) 139 KB   2
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