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User contributions for Xt810

Results for Xt810 talk block log uploads logs

A user with 790 edits. Account created on 8 October 2012.

08:5908:59, 2 November 2012 diff hist +4 Rep:Xiaojie102818 →Optimisation of chair-ts by using the frozen coordinate method
08:5808:58, 2 November 2012 diff hist −31 Rep:Xiaojie102818 →Optimisation of chair-ts in 3-21G
08:5708:57, 2 November 2012 diff hist +3 Rep:Xiaojie102818 →Chair transition state-guess structure
08:5708:57, 2 November 2012 diff hist +3 Rep:Xiaojie102818 →"Chair" and "Boat" Transition Structures
08:5708:57, 2 November 2012 diff hist +2 Rep:Xiaojie102818 →B3LYP/6-31G* Optimised (Anti2) 1,5-hexadiene
08:5608:56, 2 November 2012 diff hist +5 Rep:Xiaojie102818 →HF/3-21G Optimised (Anti2) 1,5-hexadiene
08:5608:56, 2 November 2012 diff hist +4 Rep:Xiaojie102818 →lowest energy conformation-(gauche3)
08:5608:56, 2 November 2012 diff hist −2 Rep:Xiaojie102818 →HF/3-21G Optimised (Gauche1) 1,5-hexadiene
08:5508:55, 2 November 2012 diff hist +4 Rep:Xiaojie102818 →HF/3-21G Optimised (Gauche1) 1,5-hexadiene
08:5508:55, 2 November 2012 diff hist +3 Rep:Xiaojie102818 →Frequency Analysis of B3LYP/6-31G* Optimised (Anti2) 1,5-hexadiene
08:5408:54, 2 November 2012 diff hist −15 Rep:Xiaojie102818 →Frequency Analysis of B3LYP/6-31G* Optimised (Anti2) 1,5-hexadiene
08:5408:54, 2 November 2012 diff hist 0 N File:Anti 631.PNG No edit summary current
08:5208:52, 2 November 2012 diff hist +38 Rep:Xiaojie102818 →Optimisation of exo-ts
08:5108:51, 2 November 2012 diff hist 0 Rep:Xiaojie102818 →Optimisation of exo-ts
08:5108:51, 2 November 2012 diff hist 0 N File:Exo vf.PNG No edit summary current
08:4908:49, 2 November 2012 diff hist −1 Rep:Xiaojie102818 →EXO AND ENDO Selectivity
08:4808:48, 2 November 2012 diff hist +287 Rep:Xiaojie102818 →Geometry Information
08:4308:43, 2 November 2012 diff hist −2 Rep:Xiaojie102818 →References
08:4108:41, 2 November 2012 diff hist +160 Rep:Xiaojie102818 →References
08:3608:36, 2 November 2012 diff hist +27 Rep:Xiaojie102818 →References
08:3408:34, 2 November 2012 diff hist +67 Rep:Xiaojie102818 →References
08:3208:32, 2 November 2012 diff hist +18 Rep:Xiaojie102818 →Molecule Orbital Analysis
08:3108:31, 2 November 2012 diff hist +255 Rep:Xiaojie102818 No edit summary
08:2708:27, 2 November 2012 diff hist +62 Rep:Xiaojie102818 →Geometry Information
08:1608:16, 2 November 2012 diff hist +42 Rep:Xiaojie102818 →Geometry Information
08:1408:14, 2 November 2012 diff hist +19 Rep:Xiaojie102818 →Molecule orbital
08:1408:14, 2 November 2012 diff hist 0 N File:CIS BUTA. LUMO.PNG No edit summary current
08:0908:09, 2 November 2012 diff hist −1 Rep:Xiaojie102818 →IRC Analysis of Chair Transition state
08:0808:08, 2 November 2012 diff hist +222 Rep:Xiaojie102818 →IRC Analysis of Chair Transition state
08:0808:08, 2 November 2012 diff hist 0 N File:Ater ircpoint group.PNG No edit summary current
08:0708:07, 2 November 2012 diff hist 0 N File:Optafterirc.mol No edit summary current
08:0108:01, 2 November 2012 diff hist +3 Rep:Xiaojie102818 →Comparison Table
04:3204:32, 2 November 2012 diff hist +31 Rep:Xiaojie102818 →EXO- AND ENDO- Selectivity
03:1503:15, 2 November 2012 diff hist +193 Rep:Xiaojie102818 →Result Table
02:1002:10, 2 November 2012 diff hist +12 Rep:Xiaojie102818 →Molecule Orbital
02:0902:09, 2 November 2012 diff hist +4 Rep:Xiaojie102818 →Molecule Orbital
02:0702:07, 2 November 2012 diff hist −291 Rep:Xiaojie102818 →Molecule Orbital
02:0602:06, 2 November 2012 diff hist +295 Rep:Xiaojie102818 →Geometry Information
02:0402:04, 2 November 2012 diff hist +1 Rep:Xiaojie102818 →Optimisation of the ts
01:4601:46, 2 November 2012 diff hist 0 Rep:Xiaojie102818 →Transition State geometry for the prototype reaction and an examination of the nature of the reaction path
01:4401:44, 2 November 2012 diff hist −37 Rep:Xiaojie102818 →Molecule orbital
01:1501:15, 2 November 2012 diff hist −90 Rep:Xiaojie102818 →The Diels Alder Cycloaddition
01:1401:14, 2 November 2012 diff hist +2 Rep:Xiaojie102818 →Result Table
01:1301:13, 2 November 2012 diff hist −1 Rep:Xiaojie102818 →Result Table
01:1301:13, 2 November 2012 diff hist +277 Rep:Xiaojie102818 →Result Table
01:0801:08, 2 November 2012 diff hist −3 Rep:Xiaojie102818 →Chair TS
01:0601:06, 2 November 2012 diff hist −4 Rep:Xiaojie102818 →Optimisation of Chair and Boat by using B3LYP/6-31G*
01:0501:05, 2 November 2012 diff hist 0 Rep:Xiaojie102818 →IRC Analysis of Chair Transition state
01:0401:04, 2 November 2012 diff hist −27 Rep:Xiaojie102818 →IRC Analysis of Chair Transition state
01:0201:02, 2 November 2012 diff hist +1 Rep:Xiaojie102818 →IRC Analysis of Chair Transition state

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