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361 related items for PubMed ID: 16435830

  • 1. A quantum wave packet dynamics study of the N(2D) + H2 reaction.
    Chu TS, Han KL, Varandas AJ.
    J Phys Chem A; 2006 Feb 02; 110(4):1666-71. PubMed ID: 16435830
    [Abstract] [Full Text] [Related]

  • 2. Quantum mechanical wave packet and quasiclassical trajectory calculations for the Li + H2(+) reaction.
    Bulut N, Castillo JF, Bañares L, Aoiz FJ.
    J Phys Chem A; 2009 Dec 31; 113(52):14657-63. PubMed ID: 19621933
    [Abstract] [Full Text] [Related]

  • 3. Quantum wave packet dynamics of N(2D)+H2 reaction.
    Jayachander Rao B, Mahapatra S.
    J Chem Phys; 2007 Dec 28; 127(24):244307. PubMed ID: 18163675
    [Abstract] [Full Text] [Related]

  • 4. Exact quantum dynamics of N(2D) + H2 --> NH + H reaction: cross-sections, rate constants, and dependence on reactant rotation.
    Lin SY, Guo H.
    J Chem Phys; 2006 Jan 21; 124(3):031101. PubMed ID: 16438560
    [Abstract] [Full Text] [Related]

  • 5. Coriolis-coupled wave packet dynamics of H + HLi reaction.
    Padmanaban R, Mahapatra S.
    J Phys Chem A; 2006 May 11; 110(18):6039-46. PubMed ID: 16671673
    [Abstract] [Full Text] [Related]

  • 6. Time-dependent quantum wave packet study of the Ar+H2+→ArH(+)+H reaction on a new ab initio potential energy surface for the ground electronic state (1(2)A').
    Hu M, Xu W, Liu X, Tan R, Li H.
    J Chem Phys; 2013 May 07; 138(17):174305. PubMed ID: 23656132
    [Abstract] [Full Text] [Related]

  • 7. Quantum wave-packet dynamics of H+HLi scattering: reaction cross section and thermal rate constant.
    Padmanaban R, Mahapatra S.
    J Chem Phys; 2004 Oct 22; 121(16):7681-91. PubMed ID: 15485227
    [Abstract] [Full Text] [Related]

  • 8. A comparative study of the H + FO (v = 0, j = 0) --> (OH + F)/(HF + O) reaction from QM and QCT methods.
    Chu TS, Zhang H, Yuan SP, Fu AP, Si HZ, Tian FH, Duan YB.
    J Phys Chem A; 2009 Apr 16; 113(15):3470-5. PubMed ID: 19317412
    [Abstract] [Full Text] [Related]

  • 9. Accurate potential energy surface for the 1(2)A' state of NH(2): scaling of external correlation versus extrapolation to the complete basis set limit.
    Li YQ, Varandas AJ.
    J Phys Chem A; 2010 Sep 16; 114(36):9644-54. PubMed ID: 20218704
    [Abstract] [Full Text] [Related]

  • 10. Full dimensional time-dependent quantum dynamics study of the H + NH3 --> H2 + NH2 reaction.
    Yang M.
    J Chem Phys; 2008 Aug 14; 129(6):064315. PubMed ID: 18715077
    [Abstract] [Full Text] [Related]

  • 11. A time-dependent wave-packet quantum scattering study of the reaction H2+(v = 0-2,4,6;j = 1) + He--> HeH+ + H.
    Chu TS, Lu RF, Han KL, Tang XN, Xu HF, Ng CY.
    J Chem Phys; 2005 Jun 22; 122(24):244322. PubMed ID: 16035772
    [Abstract] [Full Text] [Related]

  • 12. Time-dependent reactive scattering for the system H- + D2 <--> HD + D- and comparison with H- + H2 <--> H2 + H-.
    Morari C, Jaquet R.
    J Phys Chem A; 2005 Apr 21; 109(15):3396-404. PubMed ID: 16833675
    [Abstract] [Full Text] [Related]

  • 13. Accurate time-dependent wave packet study of the Li + H₂⁺ reaction and its isotopic variants.
    Aslan E, Bulut N, Castillo JF, Bañares L, Roncero O, Aoiz FJ.
    J Phys Chem A; 2012 Jan 12; 116(1):132-8. PubMed ID: 22129246
    [Abstract] [Full Text] [Related]

  • 14. Accurate double many-body expansion potential energy surface by extrapolation to the complete basis set limit and dynamics calculations for ground state of NH2.
    Li Y, Yuan J, Chen M, Ma F, Sun M.
    J Comput Chem; 2013 Jul 15; 34(19):1686-96. PubMed ID: 23666848
    [Abstract] [Full Text] [Related]

  • 15. Nonadiabatic time-dependent wave packet study of the D+ + H2 reaction system.
    Chu TS, Han KL.
    J Phys Chem A; 2005 Mar 17; 109(10):2050-6. PubMed ID: 16838974
    [Abstract] [Full Text] [Related]

  • 16. Exact quantum scattering study of the Ne+H(2) (+) reaction on a new ab initio potential energy surface.
    Lv SJ, Zhang PY, Han KL, He GZ.
    J Chem Phys; 2010 Jan 07; 132(1):014303. PubMed ID: 20078157
    [Abstract] [Full Text] [Related]

  • 17. Nonadiabatic quantum dynamics calculations for the N + NH --> N(2) + H reaction.
    Yang H, Hankel M, Varandas A, Han K.
    Phys Chem Chem Phys; 2010 Sep 07; 12(33):9619-23. PubMed ID: 20607172
    [Abstract] [Full Text] [Related]

  • 18. Quantum wave-packet calculation of reaction probabilities, cross sections, and rate constants for Li + H2+ reaction.
    Gogtas F.
    J Chem Phys; 2005 Dec 22; 123(24):244301. PubMed ID: 16396531
    [Abstract] [Full Text] [Related]

  • 19. Quantum approaches for the insertion dynamics of the H+ + D2 and D+ + H2 reactive collisions.
    González-Lezana T, Aguado A, Paniagua M, Roncero O.
    J Chem Phys; 2005 Nov 15; 123(19):194309. PubMed ID: 16321090
    [Abstract] [Full Text] [Related]

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