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Journal Abstract Search

287 related items for PubMed ID: 18537419

  • 21. The benzene-argon ground-state intermolecular potential energy surface revisited.
    Capelo SB, Fernández B, Koch H, Felker PM.
    J Phys Chem A; 2009 Apr 30; 113(17):5212-6. PubMed ID: 19354204
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  • 22. Ab initio study of the mechanism for photoinduced Yl-oxygen exchange in uranyl(VI) in acidic aqueous solution.
    Réal F, Vallet V, Wahlgren U, Grenthe I.
    J Am Chem Soc; 2008 Sep 03; 130(35):11742-51. PubMed ID: 18686948
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  • 25. DFT/TDDFT exploration of the potential energy surfaces of the ground state and excited states of Fe2(S2C3H6)(CO)6: a simple functional model of the [FeFe] hydrogenase active site.
    Bertini L, Greco C, De Gioia L, Fantucci P.
    J Phys Chem A; 2009 May 14; 113(19):5657-70. PubMed ID: 19378958
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  • 32. Theoretical spectroscopy of the calcium dimer in the A 1Sigma(u)+, c3Pi(u), and a3Sigma(u)+ manifolds: an ab initio nonadiabatic treatment.
    Bussery-Honvault B, Launay JM, Korona T, Moszynski R.
    J Chem Phys; 2006 Sep 21; 125(11):114315. PubMed ID: 16999482
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  • 33. Ground state potential energy surfaces and bound states of M-He dimers (M=Cu,Ag,Au): a theoretical investigation.
    Cargnoni F, Kuś T, Mella M, Bartlett RJ.
    J Chem Phys; 2008 Nov 28; 129(20):204307. PubMed ID: 19045864
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  • 34. R12-calibrated H2O-H2 interaction: full dimensional and vibrationally averaged potential energy surfaces.
    Valiron P, Wernli M, Faure A, Wiesenfeld L, Rist C, Kedzuch S, Noga J.
    J Chem Phys; 2008 Oct 07; 129(13):134306. PubMed ID: 19045089
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  • 35. Ab initio rovibrational structure of the lowest singlet state of O2-O2.
    Carmona-Novillo E, Bartolomei M, Hernández MI, Campos-Martínez J, Hernández-Lamoneda R.
    J Chem Phys; 2012 Sep 21; 137(11):114304. PubMed ID: 22998259
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  • 37. Ab initio potential-energy surfaces of O2(X3Sigmag -, a1Deltag, b1Sigmag +) +O2 (X3Sigmag -, a1Deltag, b1Sigmag +): mechanism of quenching of O2 (a 1Deltag).
    Liu J, Morokuma K.
    J Chem Phys; 2005 Nov 22; 123(20):204319. PubMed ID: 16351268
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  • 38. Interactions of transition metal atoms in high-spin states: Cr2, Sc-Cr, and Sc-Kr.
    Rajchel L, Zuchowski PS, Kłos J, Szcześniak MM, Chałasiński G.
    J Chem Phys; 2007 Dec 28; 127(24):244302. PubMed ID: 18163670
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  • 40. Dissociative dynamics of spin-triplet and spin-singlet O2 on Ag(100).
    Alducin M, Busnengo HF, Díez Muiño R.
    J Chem Phys; 2008 Dec 14; 129(22):224702. PubMed ID: 19071934
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