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462 related items for PubMed ID: 17269121
21. Theoretical study of the reactions CF3CH2OCHF2 + OH/Cl and its product radicals and parent ether(CH3CH2OCH3) with OH. Yang L, Liu JY, Wang L, He HQ, Wang Y, Li ZS. J Comput Chem; 2008 Mar; 29(4):550-61. PubMed ID: 17705163 [Abstract] [Full Text] [Related]
22. Theoretical study and rate constant calculation for the reactions of SH (SD) with Cl2, Br2, and BrCl. Wang L, Liu JY, Li ZS, Sun CC. J Comput Chem; 2005 Jan 30; 26(2):184-93. PubMed ID: 15593347 [Abstract] [Full Text] [Related]
23. Theoretical investigation of the reactions of CF(3)CHFOCF(3) with the OH radical and Cl atom. Jia X, Liu Y, Sun J, Sun H, Su Z, Pan X, Wang R. J Phys Chem A; 2010 Jan 14; 114(1):417-24. PubMed ID: 19950919 [Abstract] [Full Text] [Related]
24. Theoretical studies on the mechanisms and dynamics of OH radicals with CH(2)FCF(2)OCHF(2) and CH(2)FOCH(2)F. Song G, Jia X, Gao Y, Luo J, Yu Y, Wang R, Pan X. J Phys Chem A; 2010 Sep 02; 114(34):9057-68. PubMed ID: 20669929 [Abstract] [Full Text] [Related]
25. Dual-level direct dynamics studies for the reactions of OH radical with bromine-substituted ethanes. Wang L, Liu JY, Gao H, Wan SQ, Li ZS. J Comput Chem; 2009 Mar 02; 30(4):611-20. PubMed ID: 18780354 [Abstract] [Full Text] [Related]
26. Direct dynamics studies on hydrogen abstraction reactions of CH3CHFCH3 and CH3CH2CH2F with OH radicals. Wang Y, Liu JY, Yang L, Zhao XL, Ji YM, Li ZS. J Phys Chem A; 2007 Aug 16; 111(32):7761-70. PubMed ID: 17655205 [Abstract] [Full Text] [Related]
27. Theoretical study on the Br + CH3SCH3 reaction. Zhang H, Zhang GL, Wang L, Liu B, Yu XY, Li ZS. J Comput Chem; 2007 May 16; 28(7):1153-9. PubMed ID: 17285559 [Abstract] [Full Text] [Related]
28. Theoretical study on the reaction of SiH(CH(3))(3) with SiH(3) radical. Zhang H, Zhang GL, Liu JY, Sun M, Liu B, Li ZS. J Comput Chem; 2009 Jan 30; 30(2):236-42. PubMed ID: 18567006 [Abstract] [Full Text] [Related]
29. Reaction-path dynamics and theoretical rate constants for the CH(n)F(4-n) + O3 --> HOOO + CH(n-1)F(4-n) (n = 2,3) reactions. Li QS, Yang J, Zhang S. J Phys Chem A; 2006 Sep 28; 110(38):11113-9. PubMed ID: 16986845 [Abstract] [Full Text] [Related]
30. Theoretical dynamic studies on the reactions of CH3C(O)CH3-nCl(n) (n = 0-3) with the chlorine atom. Ji YM, Zhao XL, Liu JY, Wang Y, Li ZS. J Comput Chem; 2008 Apr 15; 29(5):809-19. PubMed ID: 17894372 [Abstract] [Full Text] [Related]
31. Hydrogen abstraction reactions of OH radicals with CH₃CH₂CH₂Cl and CH₃CHClCH₃: a mechanistic and kinetic study. Wang L, Li Y, He H, Zhang J. J Comput Chem; 2012 Jan 05; 33(1):66-75. PubMed ID: 21952915 [Abstract] [Full Text] [Related]
32. Theoretical study and rate constants calculation for the reactions of SiH3 radical with SiH3CH3 and SiH2(CH3)2. Zhang H, Zhang GL, Liu JY, Sun M, Liu B, Li ZS. J Comput Chem; 2010 Jan 30; 31(2):403-11. PubMed ID: 19499539 [Abstract] [Full Text] [Related]
33. Direct ab initio dynamics study on the rate constants and kinetic isotope effect for the reactions of H atoms with GeDn(CH3)4-n (n = 1-4). Wu Y, Ding YH, Xiao JF, Li ZS, Huang XR, Sun CC. J Comput Chem; 2002 Nov 15; 23(14):1366-74. PubMed ID: 12214319 [Abstract] [Full Text] [Related]
34. Ab initio and kinetic calculations for the reactions of Cl with SiH(n)Cl(4-n) (n=1,2,3,4). Pei K, Li H. J Chem Phys; 2004 Oct 08; 121(14):6738-42. PubMed ID: 15473729 [Abstract] [Full Text] [Related]
35. Theoretical studies of the reaction of hydroxyl radical with methyl acetate. Yang L, Liu JY, Li ZS. J Phys Chem A; 2008 Jul 17; 112(28):6364-72. PubMed ID: 18564834 [Abstract] [Full Text] [Related]
36. Direct dynamics study of the hydrogen-abstraction reaction of 1,1,2,2,3-fluorinated propane with the hydroxyl radical. Gao H, Wang Y, Liu JY, Yang L, Li ZS, Sun CC. J Phys Chem A; 2008 May 08; 112(18):4176-85. PubMed ID: 18386852 [Abstract] [Full Text] [Related]
37. DFT and ab initio dual-level direct dynamics studies on the reactions of fluorine atom with HOCl and HOBr. Wang L, Liu JY, Li ZS, Sun CC. J Phys Chem A; 2005 Oct 13; 109(40):9123-8. PubMed ID: 16332021 [Abstract] [Full Text] [Related]
38. CH3NHNH2 + OH reaction: mechanism and dynamics studies. Liu HX, Wang Y, Yang L, Liu JY, Gao H, Li ZS, Sun CC. J Comput Chem; 2009 Nov 15; 30(14):2194-204. PubMed ID: 19242961 [Abstract] [Full Text] [Related]
39. Direct dynamics study on the reaction of acetaldehyde with ozone. Yang J, Li QS, Zhang S. J Comput Chem; 2008 Jan 30; 29(2):247-55. PubMed ID: 17559074 [Abstract] [Full Text] [Related]
40. Theoretical investigation of the hydrogen abstraction reaction of the OH radical with CH3CHF2 (HFC152-a): a dual level direct density functional theory dynamics study. Taghikhani M, Parsafar GA, Sabzyan H. J Phys Chem A; 2005 Sep 15; 109(36):8158-67. PubMed ID: 16834202 [Abstract] [Full Text] [Related] Page: [Previous] [Next] [New Search]