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.


BIOMARKERS

Molecular Biopsy of Human Tumors

- a resource for Precision Medicine *

147 related articles for article (PubMed ID: 21822326)

  • 21. Modeling adsorption and reactions of organic molecules at metal surfaces.
    Liu W; Tkatchenko A; Scheffler M
    Acc Chem Res; 2014 Nov; 47(11):3369-77. PubMed ID: 24915492
    [TBL] [Abstract][Full Text] [Related]  

  • 22. GGA versus van der Waals density functional results for mixed gold/mercury molecules and pure Au and Hg cluster properties.
    Fernández EM; Balbás LC
    Phys Chem Chem Phys; 2011 Dec; 13(46):20863-70. PubMed ID: 22006277
    [TBL] [Abstract][Full Text] [Related]  

  • 23. Assessment of two hybrid van der Waals density functionals for covalent and non-covalent binding of molecules.
    Berland K; Jiao Y; Lee JH; Rangel T; Neaton JB; Hyldgaard P
    J Chem Phys; 2017 Jun; 146(23):234106. PubMed ID: 28641426
    [TBL] [Abstract][Full Text] [Related]  

  • 24. Chemical accuracy for the van der Waals density functional.
    Klimeš J; Bowler DR; Michaelides A
    J Phys Condens Matter; 2010 Jan; 22(2):022201. PubMed ID: 21386245
    [TBL] [Abstract][Full Text] [Related]  

  • 25. Structure and binding in crystals of cagelike molecules: hexamine and platonic hydrocarbons.
    Berland K; Hyldgaard P
    J Chem Phys; 2010 Apr; 132(13):134705. PubMed ID: 20387952
    [TBL] [Abstract][Full Text] [Related]  

  • 26. Importance of Van der Waals Interactions in Hydrogen Adsorption on a Silicon-carbide Nanotube Revisited with vdW-DFT and Quantum Monte Carlo.
    Prayogo GI; Shin H; Benali A; Maezono R; Hongo K
    ACS Omega; 2021 Sep; 6(38):24630-24636. PubMed ID: 34604645
    [TBL] [Abstract][Full Text] [Related]  

  • 27. Rationale for switching to nonlocal functionals in density functional theory.
    Lazić P; Atodiresei N; Caciuc V; Brako R; Gumhalter B; Blügel S
    J Phys Condens Matter; 2012 Oct; 24(42):424215. PubMed ID: 23032957
    [TBL] [Abstract][Full Text] [Related]  

  • 28. Effect of van der Waals interactions on the chemisorption and physisorption of phenol and phenoxy on metal surfaces.
    Peköz R; Donadio D
    J Chem Phys; 2016 Sep; 145(10):104701. PubMed ID: 27634269
    [TBL] [Abstract][Full Text] [Related]  

  • 29. van der Waals forces in density functional theory: a review of the vdW-DF method.
    Berland K; Cooper VR; Lee K; Schröder E; Thonhauser T; Hyldgaard P; Lundqvist BI
    Rep Prog Phys; 2015 Jun; 78(6):066501. PubMed ID: 25978530
    [TBL] [Abstract][Full Text] [Related]  

  • 30. Binding and Diffusion of Lithium in Graphite: Quantum Monte Carlo Benchmarks and Validation of van der Waals Density Functional Methods.
    Ganesh P; Kim J; Park C; Yoon M; Reboredo FA; Kent PR
    J Chem Theory Comput; 2014 Dec; 10(12):5318-23. PubMed ID: 26583215
    [TBL] [Abstract][Full Text] [Related]  

  • 31. Electronic properties of molecules and surfaces with a self-consistent interatomic van der Waals density functional.
    Ferri N; DiStasio RA; Ambrosetti A; Car R; Tkatchenko A
    Phys Rev Lett; 2015 May; 114(17):176802. PubMed ID: 25978248
    [TBL] [Abstract][Full Text] [Related]  

  • 32. Density Functional Model for van der Waals Interactions: Unifying Many-Body Atomic Approaches with Nonlocal Functionals.
    Hermann J; Tkatchenko A
    Phys Rev Lett; 2020 Apr; 124(14):146401. PubMed ID: 32338971
    [TBL] [Abstract][Full Text] [Related]  

  • 33. 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; 134(2):024516. PubMed ID: 21241129
    [TBL] [Abstract][Full Text] [Related]  

  • 34. The role of van der Waals forces in water adsorption on metals.
    Carrasco J; Klimeš J; Michaelides A
    J Chem Phys; 2013 Jan; 138(2):024708. PubMed ID: 23320714
    [TBL] [Abstract][Full Text] [Related]  

  • 35. The role of van der Waals interactions in the adsorption of noble gases on metal surfaces.
    Chen DL; Al-Saidi WA; Johnson JK
    J Phys Condens Matter; 2012 Oct; 24(42):424211. PubMed ID: 23032730
    [TBL] [Abstract][Full Text] [Related]  

  • 36. Improved proton-transfer barriers with van der Waals density functionals: Role of repulsive non-local correlation.
    Seyedraoufi S; Berland K
    J Chem Phys; 2022 Jun; 156(24):244106. PubMed ID: 35778093
    [TBL] [Abstract][Full Text] [Related]  

  • 37. Role of van der Waals interaction in forming molecule-metal junctions: flat organic molecules on the Au(111) surface.
    Mura M; Gulans A; Thonhauser T; Kantorovich L
    Phys Chem Chem Phys; 2010 May; 12(18):4759-67. PubMed ID: 20428556
    [TBL] [Abstract][Full Text] [Related]  

  • 38. Describing adsorption of benzene, thiophene, and xenon on coinage metals by using the Zaremba-Kohn theory-based model.
    Adhikari S; Nepal NK; Tang H; Ruzsinszky A
    J Chem Phys; 2021 Mar; 154(12):124705. PubMed ID: 33810670
    [TBL] [Abstract][Full Text] [Related]  

  • 39. Influence of the van der Waals interaction in the dissociation dynamics of N2 on W(110) from first principles.
    Martin-Gondre L; Juaristi JI; Blanco-Rey M; Díez Muiño R; Alducin M
    J Chem Phys; 2015 Feb; 142(7):074704. PubMed ID: 25702021
    [TBL] [Abstract][Full Text] [Related]  

  • 40. Quantitative Understanding of van der Waals Interactions by Analyzing the Adsorption Structure and Low-Frequency Vibrational Modes of Single Benzene Molecules on Silver.
    Yuan D; Han Z; Czap G; Chiang CL; Xu C; Ho W; Wu R
    J Phys Chem Lett; 2016 Jun; 7(12):2228-33. PubMed ID: 27232051
    [TBL] [Abstract][Full Text] [Related]  

    [Previous]   [Next]    [New Search]
    of 8.