These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.
2. Reduced dimensionality quantum dynamics of CH3 + CH4 --> CH4 + CH3: symmetric hydrogen exchange on an Ab initio potential. Remmert SM; Banks ST; Clary DC J Phys Chem A; 2009 Apr; 113(16):4255-64. PubMed ID: 19254017 [TBL] [Abstract][Full Text] [Related]
3. Dynamical resonances in the fluorine atom reaction with the hydrogen molecule. Yang X; Zhang DH Acc Chem Res; 2008 Aug; 41(8):981-9. PubMed ID: 18710199 [TBL] [Abstract][Full Text] [Related]
4. New analytical potential energy surface for the F(2P)+CH4 hydrogen abstraction reaction: kinetics and dynamics. Espinosa-García J; Bravo JL; Rangel C J Phys Chem A; 2007 Apr; 111(14):2761-71. PubMed ID: 17388340 [TBL] [Abstract][Full Text] [Related]
5. State-selected dynamics of the complex-forming bimolecular reaction Cl- +CH3 Cl'-->ClCH3+Cl'-: a four-dimensional quantum scattering study. Hennig C; Schmatz S J Chem Phys; 2004 Jul; 121(1):220-36. PubMed ID: 15260540 [TBL] [Abstract][Full Text] [Related]
6. Quasi-classical trajectory calculations of the hydrogen abstraction reaction H + NH3. Espinosa-García J; Corchado JC J Phys Chem A; 2010 Jun; 114(21):6194-200. PubMed ID: 20459146 [TBL] [Abstract][Full Text] [Related]
7. Quasi-classical trajectory study of the F + CD4 reaction dynamics. Espinosa-García J J Phys Chem A; 2007 May; 111(18):3497-501. PubMed ID: 17432840 [TBL] [Abstract][Full Text] [Related]
8. Searching for resonances in the reaction Cl+CH4-->HCl+CH3: quantum versus quasiclassical dynamics and comparison with experiments. Martínez R; González M; Defazio P; Petrongolo C J Chem Phys; 2007 Sep; 127(10):104302. PubMed ID: 17867742 [TBL] [Abstract][Full Text] [Related]
9. Quasi-classical trajectory study of Si+O2-->SiO+O reaction. Dayou F; Tchang-Brillet WU; Monnerville M J Chem Phys; 2005 Aug; 123(8):084306. PubMed ID: 16164290 [TBL] [Abstract][Full Text] [Related]
10. Collision energy dependence of the O(1D) + HCl --> OH + Cl(2P) reaction studied by crossed beam scattering and quasiclassical trajectory calculations on ab initio potential energy surfaces. Kohguchi H; Suzuki T; Nanbu S; Ishida T; Mil'nikov GV; Oloyede P; Nakamura H J Phys Chem A; 2008 Feb; 112(5):818-25. PubMed ID: 18189375 [TBL] [Abstract][Full Text] [Related]
11. State-to-state dynamics analysis of the F + CHD3 reaction: a quasiclassical trajectory study. Espinosa-García J; Bravo JL J Phys Chem A; 2008 Jul; 112(27):6059-65. PubMed ID: 18549197 [TBL] [Abstract][Full Text] [Related]
12. Product angular distribution for the H + CD4 --> HD + CD3 reaction. Rangel C; Sansón J; Corchado JC; Espinosa-Garcia J; Nyman G J Phys Chem A; 2006 Sep; 110(37):10715-9. PubMed ID: 16970361 [TBL] [Abstract][Full Text] [Related]
13. A simple picture for the rotational enhancement of the rate for the F + HCl --> HF + Cl reaction: a dynamical study using a new ab initio potential energy surface. Hayes MY; Deskevich MP; Nesbitt DJ; Takahashi K; Skodje RT J Phys Chem A; 2006 Jan; 110(2):436-44. PubMed ID: 16405315 [TBL] [Abstract][Full Text] [Related]
14. Differential and integral cross sections of the N(2D)+H2-->NH+H reaction from exact quantum and quasi-classical trajectory calculations. Lin SY; Bañares L; Guo H J Phys Chem A; 2007 Mar; 111(12):2376-84. PubMed ID: 17388329 [TBL] [Abstract][Full Text] [Related]
15. Observation of Feshbach resonances in the F + H2 --> HF + H reaction. Qiu M; Ren Z; Che L; Dai D; Harich SA; Wang X; Yang X; Xu C; Xie D; Gustafsson M; Skodje RT; Sun Z; Zhang DH Science; 2006 Mar; 311(5766):1440-3. PubMed ID: 16527975 [TBL] [Abstract][Full Text] [Related]
16. Ab initio rate constants from hyperspherical quantum scattering: application to H+C2H6 and H+CH3OH. Kerkeni B; Clary DC J Chem Phys; 2004 Oct; 121(14):6809-21. PubMed ID: 15473738 [TBL] [Abstract][Full Text] [Related]
17. Adiabatic and nonadiabatic dynamics in the CH3(CD3)+HCl reaction. Retail B; Pearce JK; Greaves SJ; Rose RA; Orr-Ewing AJ J Chem Phys; 2008 May; 128(18):184303. PubMed ID: 18532808 [TBL] [Abstract][Full Text] [Related]
18. An improved treatment of spectator mode vibrations in reduced dimensional quantum dynamics: application to the hydrogen abstraction reactions mu + CH4, H + CH4, D + CH4, and CH3 + CH4. Banks ST; Tautermann CS; Remmert SM; Clary DC J Chem Phys; 2009 Jul; 131(4):044111. PubMed ID: 19655841 [TBL] [Abstract][Full Text] [Related]
19. Reactive resonances in the F + CHD3 reaction--a quantum dynamics study. von Horsten HF; Clary DC Phys Chem Chem Phys; 2011 Mar; 13(10):4340-56. PubMed ID: 21264397 [TBL] [Abstract][Full Text] [Related]
20. Role of the C-H stretch mode excitation in the dynamics of the Cl + CHD3 reaction: a quasi-classical trajectory calculation. Espinosa-García J J Phys Chem A; 2007 Oct; 111(39):9654-61. PubMed ID: 17824676 [TBL] [Abstract][Full Text] [Related] [Next] [New Search]