These tools will no longer be maintained as of December 31, 2024. Archived website can be found here. PubMed4Hh GitHub repository can be found here. Contact NLM Customer Service if you have questions.


Pubmed for Handhelds

PUBMED FOR HANDHELDS

Journal Abstract Search

356 related items for PubMed ID: 18532833

  • 1. Molecular dynamics simulations on the local order of liquid and amorphous ZnTe.
    Rino JP, Borges D, Mota RC, Silva MA.
    J Chem Phys; 2008 May 14; 128(18):184704. PubMed ID: 18532833
    [Abstract] [Full Text] [Related]

  • 2. The roles of electronic exchange and correlation in charge-transfer- to-solvent dynamics: Many-electron nonadiabatic mixed quantum/classical simulations of photoexcited sodium anions in the condensed phase.
    Glover WJ, Larsen RE, Schwartz BJ.
    J Chem Phys; 2008 Oct 28; 129(16):164505. PubMed ID: 19045282
    [Abstract] [Full Text] [Related]

  • 3. Nonmetallic electronegativity equalization and point-dipole interaction model including exchange interactions for molecular dipole moments and polarizabilities.
    Smalø HS, Astrand PO, Jensen L.
    J Chem Phys; 2009 Jul 28; 131(4):044101. PubMed ID: 19655831
    [Abstract] [Full Text] [Related]

  • 4. Molecular dynamics study of polarizability anisotropy relaxation in aromatic liquids and its connection with local structure.
    Elola MD, Ladanyi BM.
    J Phys Chem B; 2006 Aug 10; 110(31):15525-41. PubMed ID: 16884276
    [Abstract] [Full Text] [Related]

  • 5. Density, structure, and dynamics of water: the effect of van der Waals interactions.
    Wang J, Román-Pérez G, Soler JM, Artacho E, Fernández-Serra MV.
    J Chem Phys; 2011 Jan 14; 134(2):024516. PubMed ID: 21241129
    [Abstract] [Full Text] [Related]

  • 6. Amorphous silica modeled with truncated and screened Coulomb interactions: a molecular dynamics simulation study.
    Carré A, Berthier L, Horbach J, Ispas S, Kob W.
    J Chem Phys; 2007 Sep 21; 127(11):114512. PubMed ID: 17887862
    [Abstract] [Full Text] [Related]

  • 7. Theoretical and computational investigations on thermodynamic properties, effective site diameters, and molecular free volume of carbon disulfide fluid.
    Eskandari Nasrabad A, Laghaei R.
    J Chem Phys; 2006 Oct 21; 125(15):154505. PubMed ID: 17059270
    [Abstract] [Full Text] [Related]

  • 8. Investigating pressure effects on structural and dynamical properties of liquid methanol with many-body interactions.
    Wick CD, Dang LX.
    J Chem Phys; 2005 Nov 08; 123(18):184503. PubMed ID: 16292910
    [Abstract] [Full Text] [Related]

  • 9. Structure of liquid nitromethane: comparison of simulation and diffraction studies.
    Megyes T, Bálint S, Grósz T, Radnai T, Bakó I, Almásy L.
    J Chem Phys; 2007 Apr 28; 126(16):164507. PubMed ID: 17477614
    [Abstract] [Full Text] [Related]

  • 10. Liquid-vapor equilibrium and surface tension of nonconformal molecular fluids.
    Del Río F, Díaz-Herrera E, Avalos E, Alejandre J.
    J Chem Phys; 2005 Jan 15; 122(3):34504. PubMed ID: 15740206
    [Abstract] [Full Text] [Related]

  • 11. Molecular dynamics study of polarization effects on AgI.
    Bitrián V, Trullàs J.
    J Phys Chem B; 2008 Feb 14; 112(6):1718-28. PubMed ID: 18205347
    [Abstract] [Full Text] [Related]

  • 12. Ab initio molecular dynamics of liquid hydrogen chloride.
    Dubois V, Pasquarello A.
    J Chem Phys; 2005 Mar 15; 122(11):114512. PubMed ID: 15836234
    [Abstract] [Full Text] [Related]

  • 13. First principles molecular dynamics of molten NaI: structure, self-diffusion, polarization effects, and charge transfer.
    Galamba N, Costa Cabral BJ.
    J Chem Phys; 2007 Sep 07; 127(9):094506. PubMed ID: 17824747
    [Abstract] [Full Text] [Related]

  • 14. Four phases of amorphous water: Simulations versus experiment.
    Brovchenko I, Oleinikova A.
    J Chem Phys; 2006 Apr 28; 124(16):164505. PubMed ID: 16674144
    [Abstract] [Full Text] [Related]

  • 15. Local structure and thermodynamics of a core-softened potential fluid: theory and simulation.
    Zhou S, Jamnik A, Wolfe E, Buldyrev SV.
    Chemphyschem; 2007 Jan 08; 8(1):138-47. PubMed ID: 17121412
    [Abstract] [Full Text] [Related]

  • 16. Phosphorus: first principle simulation of a liquid-liquid phase transition.
    Ghiringhelli LM, Meijer EJ.
    J Chem Phys; 2005 May 08; 122(18):184510. PubMed ID: 15918732
    [Abstract] [Full Text] [Related]

  • 17. Molecular dynamics simulation of amorphous SiO2 nanoparticles.
    Hoang VV.
    J Phys Chem B; 2007 Nov 08; 111(44):12649-56. PubMed ID: 17944505
    [Abstract] [Full Text] [Related]

  • 18. Molecular dynamics study of polarizable ion models for molten AgBr.
    Bitrian V, Trullàs J.
    J Phys Chem B; 2006 Apr 13; 110(14):7490-9. PubMed ID: 16599529
    [Abstract] [Full Text] [Related]

  • 19. Structural, electronic, and vibrational properties of high-density amorphous silicon: a first-principles molecular-dynamics study.
    Morishita T.
    J Chem Phys; 2009 May 21; 130(19):194709. PubMed ID: 19466857
    [Abstract] [Full Text] [Related]

  • 20. Ionic microgels as model systems for colloids with an ultrasoft electrosteric repulsion: structure and thermodynamics.
    Gottwald D, Likos CN, Kahl G, Löwen H.
    J Chem Phys; 2005 Feb 15; 122(7):074903. PubMed ID: 15743266
    [Abstract] [Full Text] [Related]

    Page: [Next] [New Search]
    of 18.