User contributions for Rg1712

5 December 2014

• 09:2609:26, 5 December 2014 diff hist +78 Rep:Mod:phys3RG1712 →Comparison of Geometries - HF/3-21G vs. B3LYP/6-31G
• 09:2409:24, 5 December 2014 diff hist +29 Rep:Mod:phys3RG1712 →Introduction to Density Functional Theory
• 09:2309:23, 5 December 2014 diff hist −449 Rep:Mod:phys3RG1712 →Introduction to Density Functional Theory
• 09:2109:21, 5 December 2014 diff hist −8 Rep:Mod:phys3RG1712 →Introduction to Density Functional Theory
• 09:2009:20, 5 December 2014 diff hist −4 Rep:Mod:phys3RG1712 →Introduction to Density Functional Theory
• 09:1709:17, 5 December 2014 diff hist 0 Rep:Mod:phys3RG1712 →8 or 9 Local Minima for 1,5-Hexadiene?
• 09:1709:17, 5 December 2014 diff hist −4 Rep:Mod:phys3RG1712 →Further Confusion and Movement Towards a Resolution
• 09:1309:13, 5 December 2014 diff hist +51 Rep:Mod:phys3RG1712 →Successful Calculation
• 09:0709:07, 5 December 2014 diff hist +1 Rep:Mod:phys3RG1712 →Prelude to The Cope Rearrangement Tutorial
• 03:2103:21, 5 December 2014 diff hist 0 Rep:Mod:phys3RG1712 →Endo and Exo Transition Structures
• 03:2103:21, 5 December 2014 diff hist +1 Rep:Mod:phys3RG1712 →Activation Energy
• 03:2003:20, 5 December 2014 diff hist 0 Rep:Mod:phys3RG1712 →Analysis of the Regioselectivity of the Diels-Alder Reaction
• 03:1903:19, 5 December 2014 diff hist +4 Rep:Mod:phys3RG1712 →The Prototype Diels-Alder Reaction
• 03:1803:18, 5 December 2014 diff hist +47 Rep:Mod:phys3RG1712 →The Prototype Diels-Alder Reaction
• 03:1703:17, 5 December 2014 diff hist +40 Rep:Mod:phys3RG1712 →Considering The Reactants
• 03:1603:16, 5 December 2014 diff hist 0 Rep:Mod:phys3RG1712 →Cis-Butadiene
• 03:1403:14, 5 December 2014 diff hist 0 Rep:Mod:phys3RG1712 →Optimisation of the Chair and Boat Transition Structures
• 03:1203:12, 5 December 2014 diff hist 0 Rep:Mod:phys3RG1712 →A Frequency Calculation and Thermochemical Properties
• 03:1203:12, 5 December 2014 diff hist 0 Rep:Mod:phys3RG1712 →Comparison of Geometries - HF/3-21G vs. B3LYP/6-31G
• 03:1203:12, 5 December 2014 diff hist 0 Rep:Mod:phys3RG1712 →A Global Minimum for 1,5-Hexadiene?
• 03:1103:11, 5 December 2014 diff hist +1 Rep:Mod:phys3RG1712 →8 or 9 Local Minima for 1,5-Hexadiene?
• 03:0903:09, 5 December 2014 diff hist +1,898 Rep:Mod:phys3RG1712 →Conclusions
• 02:5502:55, 5 December 2014 diff hist +250 Rep:Mod:phys3RG1712 →Activation Energy of the Cope Rearrangement
• 02:5102:51, 5 December 2014 diff hist −2 Rep:Mod:phys3RG1712 →A Frequency Calculation and Thermochemical Properties
• 02:5102:51, 5 December 2014 diff hist −103 Rep:Mod:phys3RG1712 →A Frequency Calculation and Thermochemical Properties
• 02:4902:49, 5 December 2014 diff hist +912 Rep:Mod:phys3RG1712 →AM1 - Neglected Factors?
• 02:4202:42, 5 December 2014 diff hist +34 Rep:Mod:phys3RG1712 →Activation Energies
• 02:4102:41, 5 December 2014 diff hist +260 Rep:Mod:phys3RG1712 →Activation Energies
• 02:3602:36, 5 December 2014 diff hist 0 Rep:Mod:phys3RG1712 →References
• 02:3502:35, 5 December 2014 diff hist +222 Rep:Mod:phys3RG1712 →Activation Energies
• 02:3402:34, 5 December 2014 diff hist +259 Rep:Mod:phys3RG1712 →In Search of the Secondary Overlap Effect
• 02:3202:32, 5 December 2014 diff hist +1,371 Rep:Mod:phys3RG1712 →In Search of the Secondary Overlap Effect
• 02:2002:20, 5 December 2014 diff hist +187 Rep:Mod:phys3RG1712 →Endo and Exo Transition Structures
• 02:1602:16, 5 December 2014 diff hist +52 Rep:Mod:phys3RG1712 →Endo and Exo Transition Structures
• 02:0602:06, 5 December 2014 diff hist +98 Rep:Mod:phys3RG1712 →Endo and Exo Transition Structures
• 02:0402:04, 5 December 2014 diff hist +43 Rep:Mod:phys3RG1712 →Endo and Exo Transition Structures
• 02:0202:02, 5 December 2014 diff hist +1,058 Rep:Mod:phys3RG1712 →Endo and Exo Transition Structures
• 01:3701:37, 5 December 2014 diff hist 0 Rep:Mod:phys3RG1712 →References
• 01:3701:37, 5 December 2014 diff hist +105 Rep:Mod:phys3RG1712 →References
• 01:3101:31, 5 December 2014 diff hist +941 Rep:Mod:phys3RG1712 →Endo and Exo Transition Structures
• 01:1701:17, 5 December 2014 diff hist +233 Rep:Mod:phys3RG1712 →Endo and Exo Transition Structures
• 01:0901:09, 5 December 2014 diff hist +180 Rep:Mod:phys3RG1712 →Successful Calculation
• 00:4200:42, 5 December 2014 diff hist +1,346 Rep:Mod:phys3RG1712 →Activation Energy
• 00:3100:31, 5 December 2014 diff hist +91 Rep:Mod:phys3RG1712 →References
• 00:3000:30, 5 December 2014 diff hist +14 Rep:Mod:phys3RG1712 →Activation Energy
• 00:2800:28, 5 December 2014 diff hist 0 Rep:Mod:phys3RG1712 →References
• 00:2700:27, 5 December 2014 diff hist +53 Rep:Mod:phys3RG1712 →Activation Energy
• 00:2100:21, 5 December 2014 diff hist +460 Rep:Mod:phys3RG1712 →Activation Energy of the Cope Rearrangement
• 00:1700:17, 5 December 2014 diff hist +43 Rep:Mod:phys3RG1712 →Activation Energy of the Cope Rearrangement
• 00:1400:14, 5 December 2014 diff hist +26 Rep:Mod:phys3RG1712 →Activation Energies