User contributions for Jp1713

28 January 2016

• 14:4314:43, 28 January 2016 diff hist −1 User:Jp1713 →Optimising the chair by calculating force constants
• 14:4314:43, 28 January 2016 diff hist +34 User:Jp1713 →Optimising the chair by calculating force constants
• 14:4314:43, 28 January 2016 diff hist −21 User:Jp1713 →Frequency Analysis at 298.15 K
• 14:4214:42, 28 January 2016 diff hist +2 User:Jp1713 →Frequency Analysis at 298.15 K
• 14:4214:42, 28 January 2016 diff hist −26 User:Jp1713 →Comparing Geometries
• 14:4114:41, 28 January 2016 diff hist +2 User:Jp1713 →Comparing Geometries
• 14:4114:41, 28 January 2016 diff hist +36 User:Jp1713 →1,5-hexadiene Antiperiplanar conformer re-optimisation
• 14:4114:41, 28 January 2016 diff hist +35 User:Jp1713 →1,5-hexadiene Antiperiplanar conformer re-optimisation
• 14:4014:40, 28 January 2016 diff hist −24 User:Jp1713 →1,5-hexadiene Gauche3 conformer optimisation: Lowest energy conformer
• 14:4014:40, 28 January 2016 diff hist −40 User:Jp1713 →1,5-hexadiene Gauche3 conformer optimisation: Lowest energy conformer
• 14:3814:38, 28 January 2016 diff hist +35 User:Jp1713 →1,5-hexadiene Gauche3 conformer optimisation: Lowest energy conformer
• 14:3814:38, 28 January 2016 diff hist +35 User:Jp1713 →1,5-hexadiene Gauche conformer optimisation
• 14:3014:30, 28 January 2016 diff hist −5 User:Jp1713 →Running the Intrinsic Reaction Coordinate Calculation (IRC)
• 14:2814:28, 28 January 2016 diff hist +35 User:Jp1713 →1,5-hexadiene Antiperiplanar conformer optimisation
• 14:1814:18, 28 January 2016 diff hist +2 User:Jp1713 →Conclusion
• 14:1614:16, 28 January 2016 diff hist 0 User:Jp1713 →Analysing the activation energies of the chair and boat transition structures
• 14:1614:16, 28 January 2016 diff hist +38 User:Jp1713 →Analysing the activation energies of the chair and boat transition structures
• 14:1414:14, 28 January 2016 diff hist −2 User:Jp1713 →Analysing the activation energies of the chair and boat transition structures
• 14:1414:14, 28 January 2016 diff hist 0 User:Jp1713 →Optimising the chair and boat transition structures
• 14:1314:13, 28 January 2016 diff hist +1 User:Jp1713 →Optimising the chair by the redundant coordinate editor
• 14:1314:13, 28 January 2016 diff hist +3 User:Jp1713 →Optimising the chair by the redundant coordinate editor
• 14:1214:12, 28 January 2016 diff hist +4 User:Jp1713 →Comparing Geometries
• 14:1114:11, 28 January 2016 diff hist 0 User:Jp1713 →1,5-hexadiene Antiperiplanar conformer re-optimisation
• 14:1014:10, 28 January 2016 diff hist 0 User:Jp1713 →1,5-hexadiene Antiperiplanar conformer re-optimisation
• 14:0714:07, 28 January 2016 diff hist +7 User:Jp1713 →1,5-hexadiene Antiperiplanar conformer re-optimisation
• 14:0514:05, 28 January 2016 diff hist +9 User:Jp1713 →Comparing Geometries
• 13:5613:56, 28 January 2016 diff hist −26 User:Jp1713 →Endo
• 13:5513:55, 28 January 2016 diff hist −26 User:Jp1713 →Exo
• 13:5313:53, 28 January 2016 diff hist −2 User:Jp1713 →Running the Intrinsic Reaction Coordinate Calculation (IRC)
• 13:5213:52, 28 January 2016 diff hist 0 User:Jp1713 →Running the Intrinsic Reaction Coordinate Calculation (IRC)
• 13:5113:51, 28 January 2016 diff hist 0 User:Jp1713 →Running the Intrinsic Reaction Coordinate Calculation (IRC)
• 13:2613:26, 28 January 2016 diff hist −35 User:Jp1713 →Introduction
• 13:2413:24, 28 January 2016 diff hist +2 User:Jp1713 →Cope Rearrangement Tutorial
• 13:2213:22, 28 January 2016 diff hist +4 User:Jp1713 →Endo
• 13:2213:22, 28 January 2016 diff hist +4 User:Jp1713 →Exo
• 13:2213:22, 28 January 2016 diff hist +4 User:Jp1713 →Running the Intrinsic Reaction Coordinate Calculation (IRC)
• 13:2113:21, 28 January 2016 diff hist +11 User:Jp1713 →Running the Intrinsic Reaction Coordinate Calculation (IRC)
• 13:2013:20, 28 January 2016 diff hist −10 User:Jp1713 →Running the Intrinsic Reaction Coordinate Calculation (IRC)
• 13:1913:19, 28 January 2016 diff hist −17 User:Jp1713 →Transition State Optimisation
• 13:1813:18, 28 January 2016 diff hist −26 User:Jp1713 →Running the Intrinsic Reaction Coordinate Calculation (IRC)
• 13:1813:18, 28 January 2016 diff hist +20 User:Jp1713 →Optimising the boat by QST2 and QST3 methods
• 13:1513:15, 28 January 2016 diff hist +23 User:Jp1713 →Exo
• 13:1113:11, 28 January 2016 diff hist −6 User:Jp1713 →Transition State HOMO and LUMO
• 13:1013:10, 28 January 2016 diff hist +25 User:Jp1713 →Running the Intrinsic Reaction Coordinate Calculation (IRC)
• 13:1013:10, 28 January 2016 diff hist +12 User:Jp1713 →Running the Intrinsic Reaction Coordinate Calculation (IRC)
• 13:0813:08, 28 January 2016 diff hist +11 User:Jp1713 →Running the Intrinsic Reaction Coordinate Calculation (IRC)
• 13:0713:07, 28 January 2016 diff hist +18 User:Jp1713 →Optimising the boat by QST2 and QST3 methods
• 13:0713:07, 28 January 2016 diff hist 0 User:Jp1713 →Optimising the boat by QST2 and QST3 methods
• 13:0513:05, 28 January 2016 diff hist +7 User:Jp1713 →Optimising the boat by QST2 and QST3 methods
• 13:0413:04, 28 January 2016 diff hist +11 User:Jp1713 →Optimising the boat by QST2 and QST3 methods