User contributions for Sc1307
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26 March 2010
- 13:2513:25, 26 March 2010 diff hist +12 Rep:Module3:scastiglione1 →'''<u>Part 1.2.6: Activation Energies For The Transition Structures</u>'''
- 13:2513:25, 26 March 2010 diff hist +878 Rep:Module3:scastiglione1 →'''<u>Part 1.2.6: Activation Energies For The Transition Structures</u>'''
- 13:1613:16, 26 March 2010 diff hist +742 Rep:Module3:scastiglione1 →'''<u>Part 1.2.6: Activation Energies For The Transition Structures</u>'''
- 13:0013:00, 26 March 2010 diff hist +81 Rep:Module3:scastiglione1 →'''<u>Part 1.2.6: Activation Energies For The Transition Structures</u>'''
- 12:4312:43, 26 March 2010 diff hist −1 Rep:Module3:scastiglione1 →'''<u>Part 1.2.6: Activation Energies For The Transition Structures</u>'''
- 12:4312:43, 26 March 2010 diff hist +243 Rep:Module3:scastiglione1 →'''<u>Part 1.2.6: Activation Energies For The Transition Structures</u>'''
- 12:3912:39, 26 March 2010 diff hist +521 Rep:Module3:scastiglione1 →'''<u>Part 1.2.6: Activation Energies For The Transition Structures</u>'''
- 12:2312:23, 26 March 2010 diff hist +470 Rep:Module3:scastiglione1 →'''<u>Part 1.2.5: IRC For The Boat Transition Structure</u>'''
- 12:0612:06, 26 March 2010 diff hist +1,736 Rep:Module3:scastiglione1 →'''<u>Part 1.2.4: IRC For The Chair Transition Structure</u>'''
- 11:1311:13, 26 March 2010 diff hist +1,383 Rep:Module3:scastiglione1 →'''<u>Part 1.2.3.1: QST2 Method</u>'''
- 10:4610:46, 26 March 2010 diff hist +1 Rep:Module3:scastiglione1 →'''<u>Part 1.2.3: Optimising The Boat Transition Structure</u>'''
- 10:4510:45, 26 March 2010 diff hist 0 N File:Boatfreqimagin.gif No edit summary current
- 10:4510:45, 26 March 2010 diff hist +69 Rep:Module3:scastiglione1 →'''<u>Part 1.2.3.1: QST2 Method</u>'''
- 10:4010:40, 26 March 2010 diff hist +2 Rep:Module3:scastiglione1 →'''<u>Part 1.2.2.2: Frozen Coordinate Method</u>'''
- 10:4010:40, 26 March 2010 diff hist +80 Rep:Module3:scastiglione1 →'''<u>Part 1.2.3: Optimising The Boat Transition Structure</u>'''
- 10:3910:39, 26 March 2010 diff hist +329 Rep:Module3:scastiglione1 →'''<u>Part 1.2.3.1: QST2 Method</u>'''
- 10:3910:39, 26 March 2010 diff hist 0 N File:Boattsqts2image.jpg No edit summary current
- 10:3910:39, 26 March 2010 diff hist 0 N File:Boat TS opt freq hf.mol No edit summary current
- 10:2710:27, 26 March 2010 diff hist +1,177 Rep:Module3:scastiglione1 →'''<u>Part 1.2.2.2: Frozen Coordinate Method</u>'''
- 10:0410:04, 26 March 2010 diff hist −52 Rep:Module3:scastiglione1 →'''<u>Part 1.2.2.2: Frozen Coordinate Method</u>'''
- 09:5709:57, 26 March 2010 diff hist +390 Rep:Module3:scastiglione1 →'''<u>Part 1.2.2.2: Frozen Coordinate Method</u>'''
- 09:5709:57, 26 March 2010 diff hist 0 N File:Chair TS Approxfc.mol No edit summary current
- 09:5609:56, 26 March 2010 diff hist 0 N File:Chairtsfcimage.jpg No edit summary current
- 09:5309:53, 26 March 2010 diff hist 0 Rep:Module3:scastiglione1 →'''<u>Part 1.2.2.1: Hessian/ TS Berny Method</u>'''
- 09:5309:53, 26 March 2010 diff hist +1,004 Rep:Module3:scastiglione1 →'''<u>Part 1.2.2.1: Hessian/ TS Berny Method</u>'''
- 09:4709:47, 26 March 2010 diff hist −1 Rep:Module3:scastiglione1 →'''<u>Part 1.2.2.1: Hessian/ TS Berny Method</u>'''
- 09:4509:45, 26 March 2010 diff hist 0 N File:818 chair tsb.gif No edit summary current
- 09:4509:45, 26 March 2010 diff hist +18 Rep:Module3:scastiglione1 →'''<u>Part 1.2.2.1: Hessian/ TS Berny Method</u>'''
- 09:4409:44, 26 March 2010 diff hist 0 N File:Chairtsbimage.jpg No edit summary current
- 09:0509:05, 26 March 2010 diff hist +60 Rep:Module3:scastiglione1 →'''<u>Part 1.2.2.1: Hessian/ TS Berny Method</u>'''
- 09:0409:04, 26 March 2010 diff hist +324 Rep:Module3:scastiglione1 →'''<u>Part 1.2.2.1: Hessian/ TS Berny Method</u>'''
- 09:0409:04, 26 March 2010 diff hist 0 N File:Chair TSb opt freq hf.mol No edit summary current
- 04:3304:33, 26 March 2010 diff hist −84 Rep:Module3:scastiglione1 →'''<u>Part 1.2.3: Optimising The Boat Transition Structure</u>'''
- 04:0004:00, 26 March 2010 diff hist −33 Rep:Module3:scastiglione1 →'''<u>Part 1.2.2: Optimising The Chair Transition Structure</u>'''
- 03:5903:59, 26 March 2010 diff hist +367 Rep:Module3:scastiglione1 →'''<u>Part 1.2.2: Optimising The Chair Transition Structure</u>'''
- 03:5503:55, 26 March 2010 diff hist +136 Rep:Module3:scastiglione1 →'''<u>Part 1.2.3: Optimising The Boat Transition Structure</u>'''
- 03:5503:55, 26 March 2010 diff hist +136 Rep:Module3:scastiglione1 →'''<u>Part 1.2.2: Optimising The Chair Transition Structure</u>'''
- 03:5303:53, 26 March 2010 diff hist +335 Rep:Module3:scastiglione1 →'''<u>Part 1.2.1: Introduction</u>'''
- 03:4003:40, 26 March 2010 diff hist +420 Rep:Module3:scastiglione1 →'''<u>Part 1.2: The Chair And Boat Transition Structures</u>'''
- 03:3703:37, 26 March 2010 diff hist +301 Rep:Module3:scastiglione1 →'''<u>Part 1.1.3: Frequency Calculations </u>'''
- 03:3103:31, 26 March 2010 diff hist −9 Rep:Module3:scastiglione1 →'''<u>Part 1.1.2: Optimizing The Reactants And Products </u>'''
- 03:3003:30, 26 March 2010 diff hist −6 Rep:Module3:scastiglione1 →'''<u>Part 1.1.3: Frequency Calculations </u>'''
- 03:3003:30, 26 March 2010 diff hist +631 Rep:Module3:scastiglione1 →'''<u>Part 1.1.3: Frequency Calculations </u>'''
- 03:2203:22, 26 March 2010 diff hist +1 Rep:Module3:scastiglione1 →'''<u>Part 1.1.3: Frequency Calculations </u>'''
- 03:2103:21, 26 March 2010 diff hist +8 Rep:Module3:scastiglione1 →'''<u>Part 1.1.3: Frequency Calculations </u>'''
- 03:2103:21, 26 March 2010 diff hist +1 Rep:Module3:scastiglione1 →'''<u>Part 1.1.3: Frequency Calculations </u>'''
- 03:2003:20, 26 March 2010 diff hist +245 Rep:Module3:scastiglione1 →'''<u>Part 1.1.3: Frequency Calculations </u>'''
- 03:1103:11, 26 March 2010 diff hist +2 Rep:Module3:scastiglione1 →'''<u>Part 1.1.3: Frequency Calculations </u>'''
- 03:1103:11, 26 March 2010 diff hist +556 Rep:Module3:scastiglione1 →'''<u>Part 1.1.3: Frequency Calculations </u>'''
- 02:2202:22, 26 March 2010 diff hist +96 Rep:Module3:scastiglione1 →'''<u>Part 1.1.3: Frequency Calculations </u>'''