User contributions
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- 16:49, 21 November 2013 (diff | hist) . . (+301) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Conclusions on molecular structure)
- 16:47, 21 November 2013 (diff | hist) . . (+417) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Conclusions on molecular structure)
- 16:18, 21 November 2013 (diff | hist) . . (+1,174) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Conclusions on molecular structure)
- 15:47, 21 November 2013 (diff | hist) . . (+530) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Conclusions on molecular structure)
- 15:22, 21 November 2013 (diff | hist) . . (+660) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Conclusions on molecular structure)
- 18:43, 19 November 2013 (diff | hist) . . (-42) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Summary outputs)
- 18:41, 19 November 2013 (diff | hist) . . (+828) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→MO and NBO calculations)
- 18:37, 19 November 2013 (diff | hist) . . (+4) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→MO and NBO calculations)
- 18:37, 19 November 2013 (diff | hist) . . (+1) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Sample MOs)
- 18:37, 19 November 2013 (diff | hist) . . (+765) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→MO and NBO calculations)
- 18:18, 19 November 2013 (diff | hist) . . (+18) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Molecular orbitals and NBO charges of methyl-ligand complexes)
- 18:17, 19 November 2013 (diff | hist) . . (-3) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185
- 18:16, 19 November 2013 (diff | hist) . . (+141) . . Mod:de403e6c-ea35-4dd5-aec1-fd7e3c51f158
- 18:14, 19 November 2013 (diff | hist) . . (0) . . N File:Pk log nch33ch2cn freq.log (current)
- 18:14, 19 November 2013 (diff | hist) . . (0) . . N File:Pk log nch33ch2oh freq.log (current)
- 18:13, 19 November 2013 (diff | hist) . . (+526) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Vibrational modes)
- 18:12, 19 November 2013 (diff | hist) . . (+4,530) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Ligand influences on nitrogen metal centre complexes)
- 17:26, 19 November 2013 (diff | hist) . . (+2) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Calculation output)
- 17:25, 19 November 2013 (diff | hist) . . (+1,112) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Molecular orbitals and NBO charges of methyl-ligand complexes)
- 17:17, 19 November 2013 (diff | hist) . . (0) . . N File:Pk log nch34 egy.log (current)
- 17:17, 19 November 2013 (diff | hist) . . (0) . . N File:Pk log pch34 egy.log (current)
- 17:17, 19 November 2013 (diff | hist) . . (+628) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Molecular orbitals and NBO charges of methyl-ligand complexes)
- 17:12, 19 November 2013 (diff | hist) . . (+456) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Structures of methyl complexes)
- 17:01, 19 November 2013 (diff | hist) . . (+333) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Summary outputs)
- 16:59, 19 November 2013 (diff | hist) . . (+11) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Frequency analysis)
- 16:58, 19 November 2013 (diff | hist) . . (+1) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Vibration modes)
- 16:57, 19 November 2013 (diff | hist) . . (0) . . N File:Pk log sch33 freq.log (current)
- 16:57, 19 November 2013 (diff | hist) . . (+402) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Vibration modes)
- 14:18, 19 November 2013 (diff | hist) . . (+42) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Frequency analysis)
- 14:16, 19 November 2013 (diff | hist) . . (+429) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Convergence outputs)
- 14:15, 19 November 2013 (diff | hist) . . (+193) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Optimisations)
- 14:13, 19 November 2013 (diff | hist) . . (+330) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Summary outputs)
- 17:45, 18 November 2013 (diff | hist) . . (+683) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Optimisations)
- 17:31, 18 November 2013 (diff | hist) . . (+64) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Optimisations)
- 17:00, 18 November 2013 (diff | hist) . . (-1,009) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Vibration modes)
- 16:58, 18 November 2013 (diff | hist) . . (+28) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Frequency analysis)
- 16:57, 18 November 2013 (diff | hist) . . (+81) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Vibration modes)
- 16:55, 18 November 2013 (diff | hist) . . (-79) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Vibration modes)
- 16:54, 18 November 2013 (diff | hist) . . (+584) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Vibration modes)
- 16:51, 18 November 2013 (diff | hist) . . (0) . . N File:Pk log pch34 freq.log (current)
- 16:51, 18 November 2013 (diff | hist) . . (0) . . N File:Pk log nch34 freq.log (current)
- 16:50, 18 November 2013 (diff | hist) . . (0) . . N File:Pk log pch34 opt.log (current)
- 16:50, 18 November 2013 (diff | hist) . . (0) . . N File:Pk log nch34 opt.log (current)
- 16:49, 18 November 2013 (diff | hist) . . (+4) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Structures of methyl complexes)
- 16:49, 18 November 2013 (diff | hist) . . (+18) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Optimisation of methyl complexes)
- 16:47, 18 November 2013 (diff | hist) . . (+744) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Vibration modes)
- 16:33, 18 November 2013 (diff | hist) . . (0) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Frequency analysis)
- 16:32, 18 November 2013 (diff | hist) . . (+626) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Frequency analysis)
- 15:43, 18 November 2013 (diff | hist) . . (+63) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Optimisation of methyl complexes)
- 15:41, 18 November 2013 (diff | hist) . . (+117) . . Mod:cbf5a234-49e7-4e4b-9d5d-85cf22add185 (→Frequency analysis)
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