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- 17:00, 10 December 2014 Kl1111 talk contribs uploaded File:KL1111 NH3BH3 631G OPT.mol
- 16:58, 10 December 2014 Kl1111 talk contribs uploaded File:KL1111 NH3BH3 OPT SUMMARY.jpg
- 16:58, 10 December 2014 Kl1111 talk contribs uploaded File:KL1111 NH3BH3 631G OPT.LOG
- 16:37, 10 December 2014 Kl1111 talk contribs uploaded File:KL1111 NH3 631G MO.LOG (KL1111_NH3_631G_NBO.LOG)
- 16:10, 10 December 2014 Kl1111 talk contribs uploaded File:KL1111 NH3 CHARGE DIST.jpg
- 14:35, 10 December 2014 Kl1111 talk contribs uploaded a new version of File:KL1111 NH3 631G freq spectra.jpg
- 14:31, 10 December 2014 Kl1111 talk contribs uploaded a new version of File:KL1111 NH3 631G FREQ.LOG
- 14:28, 10 December 2014 Kl1111 talk contribs uploaded File:KL1111 NH3 631 FREQ SUMMARY.jpg
- 14:14, 10 December 2014 Kl1111 talk contribs uploaded File:KL1111 NH3 631G OPT.mol
- 14:12, 10 December 2014 Kl1111 talk contribs uploaded File:KL1111 NH3 631 OPT SUMMARY.jpg
- 14:08, 10 December 2014 Kl1111 talk contribs uploaded File:KL1111 NH3 631G OPT.LOG
- 00:48, 9 December 2014 Kl1111 talk contribs uploaded a new version of File:KL1111 NH3 631G freq spectra.jpg
- 00:46, 9 December 2014 Kl1111 talk contribs uploaded a new version of File:KL1111 NH3 631G freq spectra.jpg
- 00:44, 9 December 2014 Kl1111 talk contribs uploaded a new version of File:KL1111 NH3 631G freq spectra.jpg
- 00:42, 9 December 2014 Kl1111 talk contribs uploaded File:KL1111 NH3 631G freq spectra.jpg
- 00:34, 9 December 2014 Kl1111 talk contribs uploaded File:KL1111 NH3 631G freq Summary.jpg
- 00:33, 9 December 2014 Kl1111 talk contribs uploaded File:KL1111 NH3 631G FREQ.LOG
- 18:08, 8 December 2014 Kl1111 talk contribs uploaded File:KL1111 BH3 MO Diagram LACO 5.jpg
- 18:08, 8 December 2014 Kl1111 talk contribs uploaded File:KL1111 BH3 MO Diagram LACO 4.jpg
- 18:08, 8 December 2014 Kl1111 talk contribs uploaded File:KL1111 BH3 MO Diagram LACO 3.jpg
- 18:08, 8 December 2014 Kl1111 talk contribs uploaded File:KL1111 BH3 MO Diagram LACO 2.jpg
- 18:08, 8 December 2014 Kl1111 talk contribs uploaded File:KL1111 BH3 MO Diagram LACO 1.jpg (LCAO 1)
- 17:46, 8 December 2014 Kl1111 talk contribs uploaded File:KL1111 BH3 MO Diagram.jpg
- 14:07, 8 December 2014 Kl1111 talk contribs uploaded File:KL1111 GaBr3 frequency spectrum.jpg (KL1111_GaBr3_frequency_spectrum)
- 13:59, 8 December 2014 Kl1111 talk contribs uploaded File:KL1111 GaBr3 frequency summary.jpg (KL1111_GaBr3_frequency_summary)
- 13:56, 8 December 2014 Kl1111 talk contribs uploaded File:Kl1111 GaBr3 frequency.log (GaBr3 frequency .log file)
- 12:27, 8 December 2014 Kl1111 talk contribs uploaded a new version of File:KL1111 BH3 OPT 631 D3h SPECTRUM.jpg
- 12:26, 8 December 2014 Kl1111 talk contribs uploaded File:KL1111 BH3 OPT 631 D3h SPECTRUM.jpg
- 10:45, 8 December 2014 Kl1111 talk contribs uploaded a new version of File:KL1111 BH3 OPT 631 D3h SUMMARY.jpg
- 10:34, 8 December 2014 Kl1111 talk contribs uploaded File:KL1111 BH3 OPT 631 D3h SUMMARY.jpg
- 10:32, 8 December 2014 Kl1111 talk contribs uploaded File:KL1111 BH3 OPT 631G DP D3H.LOG (BH3 frequency file)
- 22:40, 5 December 2014 Kl1111 talk contribs uploaded File:KL1111 BBr3 OPT 631g dp.mol (BBr3 mixed pp basis set opt JMOL image)
- 22:38, 5 December 2014 Kl1111 talk contribs uploaded File:KL1111 BBr3 OPT 631 SUMMARY.jpg (BBr3 mixed pp basis set opt)
- 22:36, 5 December 2014 Kl1111 talk contribs uploaded File:KL1111 BBr3 OPT 631g dp.log (BBr3 mixed pp and basis set opt)
- 21:33, 5 December 2014 Kl1111 talk contribs uploaded File:Kl1111 GaBr3 pp optimisation2.mol (GaBr3 pseudopotential optimisation jmol image)
- 21:32, 5 December 2014 Kl1111 talk contribs uploaded File:KL1111 GaBr3 pp opt2 summary.jpg (GaBr3 pseudopotential optimisation summary table)
- 21:31, 5 December 2014 Kl1111 talk contribs uploaded File:Kl1111 GaBr3 pp optimisation2.log (GaBr3 pseusopotential optimisation final)
- 21:03, 5 December 2014 Kl1111 talk contribs uploaded File:KL1111 BH3 OPT 631G DP.LOG
- 20:58, 5 December 2014 Kl1111 talk contribs uploaded a new version of File:KL1111 BH3 OPT 631g dp.gjf
- 20:57, 5 December 2014 Kl1111 talk contribs uploaded a new version of File:KL1111 BH3 OPT 631g dp.gjf
- 20:51, 5 December 2014 Kl1111 talk contribs uploaded a new version of File:KL1111 BH3 OPT 631 SUMMARY.jpg
- 20:50, 5 December 2014 Kl1111 talk contribs uploaded a new version of File:KL1111 BH3 OPT 631g dp.gjf
- 20:40, 5 December 2014 Kl1111 talk contribs uploaded a new version of File:KL1111 BH3 OPT 631 SUMMARY.jpg
- 20:39, 5 December 2014 Kl1111 talk contribs uploaded File:KL1111 BH3 OPT 631g dp.mol (BH3 631 jmol file)
- 20:36, 5 December 2014 Kl1111 talk contribs uploaded File:KL1111 BH3 OPT 631 SUMMARY.jpg (BH3 6.31 SUMMARY)
- 20:35, 5 December 2014 Kl1111 talk contribs uploaded File:KL1111 BH3 OPT 631g dp.gjf (6.31 log file)
- 13:36, 5 December 2014 Kl1111 talk contribs uploaded File:KL1111 BH3 OPT.mol
- 13:28, 5 December 2014 Kl1111 talk contribs uploaded a new version of File:BH3 OPT LOG SUMMARY PIC.jpg
- 13:00, 5 December 2014 Kl1111 talk contribs uploaded File:BH3 OPT LOG SUMMARY PIC.jpg (Screenshot of BH3 optimization summary)
- 12:47, 5 December 2014 Kl1111 talk contribs uploaded File:KL1111 BH3 OPT.LOG (BH3 optimisation log file)