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Journal Abstract Search

184 related items for PubMed ID: 17203141

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  • 2. Atomistic simulation of solid-liquid coexistence for molecular systems: application to triazole and benzene.
    Eike DM, Maginn EJ.
    J Chem Phys; 2006 Apr 28; 124(16):164503. PubMed ID: 16674142
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  • 7. Highly accurate CCSD(T) and DFT-SAPT stabilization energies of H-bonded and stacked structures of the uracil dimer.
    Pitonák M, Riley KE, Neogrády P, Hobza P.
    Chemphyschem; 2008 Aug 04; 9(11):1636-44. PubMed ID: 18574830
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  • 10. Electrostatic energies and forces computed without explicit interparticle interactions: a linear time complexity formulation.
    Petrella RJ, Karplus M.
    J Comput Chem; 2005 Jun 04; 26(8):755-87. PubMed ID: 15800892
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  • 12. Mechanism of the hydration of carbon dioxide: direct participation of H2O versus microsolvation.
    Nguyen MT, Matus MH, Jackson VE, Vu TN, Rustad JR, Dixon DA.
    J Phys Chem A; 2008 Oct 16; 112(41):10386-98. PubMed ID: 18816037
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  • 14. The ground state tunneling splitting and the zero point energy of malonaldehyde: a quantum Monte Carlo determination.
    Viel A, Coutinho-Neto MD, Manthe U.
    J Chem Phys; 2007 Jan 14; 126(2):024308. PubMed ID: 17228955
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  • 18. Potential energy curves of diatomic molecular ions from high-resolution photoelectron spectroscopy. I. The first six electronic states of Ar2+.
    Wüest A, Merkt F.
    J Chem Phys; 2004 Jan 08; 120(2):638-46. PubMed ID: 15267898
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  • 20. Cumulant reconstruction of the three-electron reduced density matrix in the anti-Hermitian contracted Schrödinger equation.
    DePrince AE, Mazziotti DA.
    J Chem Phys; 2007 Sep 14; 127(10):104104. PubMed ID: 17867734
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