User contributions for Clc409
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6 February 2012
- 18:2918:29, 6 February 2012 diff hist +55 Rep:Mod:chilong module2 →Effect of Metal centre to CO
- 18:2718:27, 6 February 2012 diff hist +345 Rep:Mod:chilong module2 →Vibrational analysis
- 18:2418:24, 6 February 2012 diff hist 0 N File:Charged TiCO6 6311G vibration6.PNG No edit summary current
- 18:2418:24, 6 February 2012 diff hist 0 N File:Charged TiCO6 6311G vibration5.PNG No edit summary current
- 18:2418:24, 6 February 2012 diff hist 0 N File:Charged TiCO6 6311G vibration4.PNG No edit summary current
- 18:2418:24, 6 February 2012 diff hist 0 N File:Charged TiCO6 6311G vibration3.PNG No edit summary current
- 18:2418:24, 6 February 2012 diff hist 0 N File:Charged TiCO6 6311G vibration2.PNG No edit summary current
- 18:2418:24, 6 February 2012 diff hist 0 N File:Charged TiCO6 6311G vibration1.PNG No edit summary current
- 18:1918:19, 6 February 2012 diff hist 0 N File:Charged TiCO6 6311G IR vibration6.gif No edit summary current
- 18:1918:19, 6 February 2012 diff hist 0 N File:Charged TiCO6 6311G IR vibration5.gif No edit summary current
- 18:1918:19, 6 February 2012 diff hist 0 N File:Charged TiCO6 6311G IR vibration4.gif No edit summary current
- 18:1918:19, 6 February 2012 diff hist 0 N File:Charged TiCO6 6311G IR vibration3.gif No edit summary current
- 18:1918:19, 6 February 2012 diff hist 0 N File:Charged TiCO6 6311G IR vibration2.gif No edit summary current
- 18:1918:19, 6 February 2012 diff hist 0 N File:Charged TiCO6 6311G IR vibration1.gif No edit summary current
- 18:0818:08, 6 February 2012 diff hist +1,924 Rep:Mod:chilong module2 →Vibrational analysis
- 18:0618:06, 6 February 2012 diff hist 0 N File:Charged MnCO6 6311G vibration6.PNG No edit summary current
- 18:0618:06, 6 February 2012 diff hist 0 N File:Charged MnCO6 6311G vibration5.PNG No edit summary current
- 18:0618:06, 6 February 2012 diff hist 0 N File:Charged MnCO6 6311G vibration4.PNG No edit summary current
- 18:0618:06, 6 February 2012 diff hist 0 N File:Charged MnCO6 6311G vibration3.PNG No edit summary current
- 18:0618:06, 6 February 2012 diff hist 0 N File:Charged MnCO6 6311G vibration2.PNG No edit summary current
- 18:0618:06, 6 February 2012 diff hist 0 N File:Charged MnCO6 6311G vibration1.PNG No edit summary current
- 18:0018:00, 6 February 2012 diff hist 0 N File:Charged MnCO6 6311G vibration6.gif No edit summary current
- 18:0018:00, 6 February 2012 diff hist 0 N File:Charged MnCO6 6311G vibration5.gif No edit summary current
- 18:0018:00, 6 February 2012 diff hist 0 N File:Charged MnCO6 6311G vibration4.gif No edit summary current
- 18:0018:00, 6 February 2012 diff hist 0 N File:Charged MnCO6 6311G vibration2.gif No edit summary current
- 18:0018:00, 6 February 2012 diff hist 0 N File:Charged MnCO6 6311G vibration1.gif No edit summary current
- 17:2517:25, 6 February 2012 diff hist 0 N File:MnCO6 Op addedinfowithoutp.mol No edit summary current
- 17:2417:24, 6 February 2012 diff hist −1 Rep:Mod:chilong module2 →Optimization with charged complexes Basis set = (LANL2DZ for Mn, 6-31G for C,O)
- 17:2217:22, 6 February 2012 diff hist +1,450 Rep:Mod:chilong module2 →Determining suitable basis sets for Optimization
- 17:1617:16, 6 February 2012 diff hist 0 N File:Charged MnCO6 2Basis nodp CO stretch.PNG No edit summary current
- 17:1617:16, 6 February 2012 diff hist 0 N File:Charged MnCO6 2Basis nodp low fre.PNG No edit summary current
- 17:1617:16, 6 February 2012 diff hist 0 N File:Charged MnCO6 2Basis nodp con.PNG No edit summary current
- 17:1617:16, 6 February 2012 diff hist 0 N File:Charged MnCO6 2Basis nodp summary.PNG No edit summary current
- 17:1617:16, 6 February 2012 diff hist 0 N File:MnCO6 op addedinfo.mol No edit summary current
- 17:1617:16, 6 February 2012 diff hist 0 N File:Charged MnCO6 2Basis CO Stretch.PNG No edit summary current
- 17:1617:16, 6 February 2012 diff hist 0 N File:Charged MnCO6 2Basis low fre.PNG No edit summary current
- 17:1617:16, 6 February 2012 diff hist 0 N File:Charged MnCO6 2Basis con.PNG No edit summary current
- 17:1617:16, 6 February 2012 diff hist 0 N File:Charged MnCO6 2Basis summary.PNG No edit summary current
- 17:0317:03, 6 February 2012 diff hist −2 Rep:Mod:chilong module2 →LANL2DZ Optimization with non-charged complexes
- 16:5516:55, 6 February 2012 diff hist +1,343 Rep:Mod:chilong module2 →LANL2DZ Optimization with non-charged complexes
- 16:5316:53, 6 February 2012 diff hist 0 N File:TiCO6 optimised structure LAla.mol No edit summary current
- 16:5116:51, 6 February 2012 diff hist 0 N File:TiCO6 optimised structure.mol No edit summary current
- 16:5016:50, 6 February 2012 diff hist 0 N File:TiCO6 oped IR bad.PNG No edit summary current
- 16:5016:50, 6 February 2012 diff hist 0 N File:TiCO6 oped IR loW fre.PNG No edit summary current
- 16:5016:50, 6 February 2012 diff hist 0 N File:TiCO6 oped con.PNG No edit summary current
- 16:5016:50, 6 February 2012 diff hist 0 N File:TiCO6 oped summary.PNG No edit summary current
- 16:4616:46, 6 February 2012 diff hist 0 N File:Mn CO6 Oped LANL2DZ IR Bad2.PNG No edit summary current
- 16:4616:46, 6 February 2012 diff hist 0 N File:Mn CO6 Oped LANL2DZ IR Bad.PNG No edit summary current
- 16:4616:46, 6 February 2012 diff hist 0 N File:Mn CO6 Oped LANL2DZ IR loW fre.PNG No edit summary current
- 16:4616:46, 6 February 2012 diff hist 0 N File:MnCO6 optimised structure.mol No edit summary current