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Journal Abstract Search

794 related items for PubMed ID: 22176502

  • 1. Ab initio study of the intermolecular potential energy surface in the ion-induced-dipole hydrogen-bonded O2(-)(X2Πg)-H2(X1Σg(+)) complex.
    Fawzy WM.
    J Phys Chem A; 2012 Jan 26; 116(3):1069-76. PubMed ID: 22176502
    [Abstract] [Full Text] [Related]

  • 2. Correlated ab initio investigations on the intermolecular and intramolecular potential energy surfaces in the ground electronic state of the O2(-)(X2Πg)-HF(X1Σ+) complex.
    Fawzy WM, Elsayed M, Zhang Y.
    J Chem Phys; 2013 Jan 07; 138(1):014304. PubMed ID: 23298038
    [Abstract] [Full Text] [Related]

  • 3. The intermolecular potential energy surface of the ground electronic state of the O2-H2 complex.
    Fawzy WM.
    J Chem Phys; 2009 Jul 28; 131(4):044318. PubMed ID: 19655878
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  • 4. Ab initio and analytic intermolecular potentials for Ar-CH(3)OH.
    Tasić U, Alexeev Y, Vayner G, Crawford TD, Windus TL, Hase WL.
    Phys Chem Chem Phys; 2006 Oct 28; 8(40):4678-84. PubMed ID: 17047766
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  • 5. Correlated ab initio study of the ground electronic state of the O2-HF complex.
    Fawzy WM.
    J Chem Phys; 2006 Apr 28; 124(16):164303. PubMed ID: 16674131
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  • 7. Three-dimensional ab initio potential-energy surface and rovibrational spectra of the H2-Kr complex.
    Zhou Y, Xie D.
    J Chem Phys; 2005 Oct 01; 123(13):134323. PubMed ID: 16223304
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  • 11. Potential energy surface and rovibrational calculations for the Mg+-H2 and Mg+-D2 complexes.
    Dryza V, Bieske EJ, Buchachenko AA, Kłos J.
    J Chem Phys; 2011 Jan 28; 134(4):044310. PubMed ID: 21280728
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  • 12. Potential-energy surface for the electronic ground state of NH3 up to 20,000 cm-1 above equilibrium.
    Yurchenko SN, Zheng J, Lin H, Jensen P, Thiel W.
    J Chem Phys; 2005 Oct 01; 123(13):134308. PubMed ID: 16223289
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  • 13. Intermolecular potential energy surface and spectra of He-HCl with generalization to other rare gas-hydrogen halide complexes.
    Murdachaew G, Szalewicz K, Jiang H, Bacić Z.
    J Chem Phys; 2004 Dec 15; 121(23):11839-55. PubMed ID: 15634146
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  • 16. An accurate potential energy surface for the F + H2 → HF + H reaction by the coupled-cluster method.
    Chen J, Sun Z, Zhang DH.
    J Chem Phys; 2015 Jan 14; 142(2):024303. PubMed ID: 25591349
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  • 18. State of the art theoretical study and comparison to experiment for the phenol...argon complex.
    Cerný J, Tong X, Hobza P, Müller-Dethlefs K.
    J Chem Phys; 2008 Mar 21; 128(11):114319. PubMed ID: 18361583
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  • 20. An ab initio benchmark study of hydrogen bonded formamide dimers.
    Frey JA, Leutwyler S.
    J Phys Chem A; 2006 Nov 16; 110(45):12512-8. PubMed ID: 17091957
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