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Journal Abstract Search

133 related items for PubMed ID: 35539314

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  • 4. Potential energy surface for ground-state H2S via scaling of the external correlation, comparison with extrapolation to complete basis set limit, and use in reaction dynamics.
    Song YZ, Caridade PJ, Varandas AJ.
    J Phys Chem A; 2009 Aug 13; 113(32):9213-9. PubMed ID: 19624111
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  • 5. Accurate High-Level Ab Initio-Based Global Potential Energy Surface and Quantum Dynamics Calculation for the First Excited State of CH2.
    Ma H, Zhang C, Song Y, Ma F, Li Y.
    J Phys Chem A; 2021 Jul 01; 125(25):5490-5498. PubMed ID: 34137628
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  • 6. Globally accurate potential energy surface for the ground-state HCS(X2A') and its use in reaction dynamics.
    Song YZ, Zhang LL, Gao SB, Meng QT.
    Sci Rep; 2016 Nov 29; 6():37734. PubMed ID: 27898106
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  • 12. A new potential energy surface for the ground electronic state of the LiH2 system, and dynamics studies on the H((2)S) + LiH(X(1)Σ(+)) → Li((2)S) + H2(X(1)Σg(+)) reaction.
    Yuan J, He D, Chen M.
    Phys Chem Chem Phys; 2015 May 07; 17(17):11732-9. PubMed ID: 25870863
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  • 14. Global analytical potential energy surface for the electronic ground state of NH3 from high level ab initio calculations.
    Marquardt R, Sagui K, Zheng J, Thiel W, Luckhaus D, Yurchenko S, Mariotti F, Quack M.
    J Phys Chem A; 2013 Aug 15; 117(32):7502-22. PubMed ID: 23688044
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  • 15. Accurate global potential energy surface for SiH2 +(X2A1) and quantum dynamics of related reaction H(2S) + SiH+(X1Σ+).
    Gao F, Zhang L, Zhao W, Meng Q, Song Y.
    J Chem Phys; 2019 Jun 14; 150(22):224304. PubMed ID: 31202249
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  • 16. A full-dimensional global potential energy surface of H3O+(ã(3)A) for the OH+(X̃(3)Σ(-)) + H2(X̃(1)Σ(g)(+)) → H(2S) + H2O+(X̃(2)B1) reaction.
    Li A, Guo H.
    J Phys Chem A; 2014 Nov 26; 118(47):11168-76. PubMed ID: 25343584
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  • 17. Globally Accurate Potential Energy Surface for BH2+2(13A') Using the Switching Function Formalism.
    Chen J, Zhang C, Lü Y, Wang H, Li Y.
    J Phys Chem A; 2022 Jan 13; 126(1):53-60. PubMed ID: 34965124
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  • 19. Globally Accurate Potential Energy Surface for HCS(A2A″) by Extrapolation to the Complete Basis Set Limit.
    Zhang LL, Song YZ, Gao SB, Meng QT.
    J Phys Chem A; 2018 May 10; 122(18):4390-4398. PubMed ID: 29659275
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