User contributions for Jg2011
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3 February 2014
- 22:2822:28, 3 February 2014 diff hist +2,961 Rep:Mod:KA629943 →Comparison of Geometry
- 22:2522:25, 3 February 2014 diff hist 0 N File:JG CH2CHCH2.png No edit summary current
- 22:2522:25, 3 February 2014 diff hist 0 File:CH2CHCH2.png uploaded a new version of "File:CH2CHCH2.png": Reverted to version as of 20:58, 3 December 2013 current
- 22:2322:23, 3 February 2014 diff hist 0 File:CH2CHCH2.png uploaded a new version of "File:CH2CHCH2.png"
- 22:1522:15, 3 February 2014 diff hist 0 N File:JG COPE CH2CHCH2 HF3-21G OPT.LOG No edit summary current
- 16:3216:32, 3 February 2014 diff hist +66 Rep:Mod:KA629943 →Comparison of the Different Conformations
- 16:2916:29, 3 February 2014 diff hist +1,042 Rep:Mod:KA629943 →Optimization of Reactants and Products
- 16:2616:26, 3 February 2014 diff hist 0 N File:JG COPE HF3-21G GAUCHE OPT.LOG No edit summary current
- 16:0316:03, 3 February 2014 diff hist +1,236 Rep:Mod:KA629943 →Optimization DFT 6-31G(d)
- 15:2615:26, 3 February 2014 diff hist +1,141 Rep:Mod:KA629943 →Optimization DFT 6-31G(d)
- 15:2515:25, 3 February 2014 diff hist 0 N File:JG COPE DFT631GD SYN OPT.LOG No edit summary current
- 15:1015:10, 3 February 2014 diff hist 0 N File:JG COPE DFT631GD ANTI OPT FREQ.LOG No edit summary current
- 15:0315:03, 3 February 2014 diff hist +1,030 Rep:Mod:KA629943 →Comparison of the Different Conformations
- 15:0315:03, 3 February 2014 diff hist −1,030 Rep:Mod:KA629943 →Optimization DFT 6-31G(d)
- 15:0215:02, 3 February 2014 diff hist +1,029 Rep:Mod:KA629943 →Optimization of Reactants and Products
- 15:0015:00, 3 February 2014 diff hist 0 N File:JG COPE DFT631GD ANTI OPT.LOG No edit summary current
- 14:4514:45, 3 February 2014 diff hist +299 Rep:Mod:KA629943 →Comparison of the Different Conformations
- 14:3114:31, 3 February 2014 diff hist +704 Rep:Mod:KA629943 →Optimization of Reactants and Products
- 14:0214:02, 3 February 2014 diff hist +2,919 Rep:Mod:KA629943 →Optimization of Reactants and Products
- 14:0014:00, 3 February 2014 diff hist 0 N File:JG COPE HF3-21G SYN05 OPT FREQ.LOG No edit summary current
- 13:5713:57, 3 February 2014 diff hist 0 N File:JG COPE HF3-21G SYN05 OPT.LOG No edit summary current
- 13:2913:29, 3 February 2014 diff hist 0 N File:JG COPE HF3-21G SYN OPT.LOG No edit summary current
- 13:0913:09, 3 February 2014 diff hist +1 Rep:Mod:KA629943 →Optimization of Reactants and Products
- 13:0813:08, 3 February 2014 diff hist +474 Rep:Mod:KA629943 →Optimization of Reactants and Products
- 13:0113:01, 3 February 2014 diff hist 0 N File:JG COPE HF3-21G ANTI OPT FREQ.LOG No edit summary current
- 12:5812:58, 3 February 2014 diff hist +59 Rep:Mod:KA629943 →Optimization of Reactants and Products
- 12:5212:52, 3 February 2014 diff hist 0 File:JG COPE HF3-21G ANTI OPT.LOG uploaded a new version of "File:JG COPE HF3-21G ANTI OPT.LOG" current
2 February 2014
- 11:5511:55, 2 February 2014 diff hist +88 Rep:Mod:KA629943 →Optimization of Reactants and Products
- 11:5411:54, 2 February 2014 diff hist −1 Rep:Mod:KA629943 →Optimization of Reactants and Products
- 11:5211:52, 2 February 2014 diff hist +7 Rep:Mod:KA629943 →Optimization of Reactants and Products
- 11:3411:34, 2 February 2014 diff hist +339 Rep:Mod:KA629943 →Optimization of Reactants and Products
- 11:3011:30, 2 February 2014 diff hist +1,529 N Rep:Mod:KA629943 Created page with "==Part 1, The Cope Rearrangement== ===Optimization of Reactants and Products=== The 1,5-hexadiene molecule was constructed using a n-butyl fragment with two carbon atoms fragment..."
- 11:2511:25, 2 February 2014 diff hist 0 N File:JG COPE HF3-21G ANTI OPT.LOG No edit summary
31 January 2014
- 16:5716:57, 31 January 2014 diff hist +18 Rep:Mod:underhill911 →Frequency
- 16:5716:57, 31 January 2014 diff hist +17 Rep:Mod:underhill911 →Frequency
- 16:5616:56, 31 January 2014 diff hist +18 Rep:Mod:underhill911 →Vibrational analysis of GaBr3
- 16:5616:56, 31 January 2014 diff hist +17 Rep:Mod:underhill911 →Vibrational frequency of BH3
- 16:5516:55, 31 January 2014 diff hist +23 Rep:Mod:heterocyclic5memberd →Comparison of NICS Values
- 16:5416:54, 31 January 2014 diff hist +12 Rep:Mod:heterocyclic5memberd →Significance of the NICS Values
- 16:5316:53, 31 January 2014 diff hist +7 Rep:Mod:heterocyclic5memberd →Molecular Orbitals of Furan
- 16:5216:52, 31 January 2014 diff hist +7 Rep:Mod:heterocyclic5memberd →Molecular Orbitals of Pyrrole
- 16:5216:52, 31 January 2014 diff hist +1 Rep:Mod:heterocyclic5memberd →NMR Calculations (GIAO)
- 16:5116:51, 31 January 2014 diff hist 0 Rep:Mod:heterocyclic5memberd →NMR Calculations (GIAO)
- 16:5116:51, 31 January 2014 diff hist −1 Rep:Mod:heterocyclic5memberd →Comparison of Bond Lengths with Literature Data
- 16:4916:49, 31 January 2014 diff hist −6 Rep:Mod:underhill911 →Vibrational frequency of BH3
- 16:4916:49, 31 January 2014 diff hist +7 Rep:Mod:underhill911 →Vibrational analysis of GaBr3
- 16:4816:48, 31 January 2014 diff hist −2 Rep:Mod:underhill911 →Frequency
- 16:4716:47, 31 January 2014 diff hist +141 Rep:Mod:heterocyclic5memberd →Investigation into Aromaticity
- 16:4416:44, 31 January 2014 diff hist +5 Rep:Mod:underhill911 →Vibrational analysis of GaBr3
- 16:4416:44, 31 January 2014 diff hist −2 Rep:Mod:underhill911 →NH3BH3