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 *

511 related articles for article (PubMed ID: 19658882)

  • 21. Local Hybrid Density Functional for Interfaces.
    Borlido P; Marques MAL; Botti S
    J Chem Theory Comput; 2018 Feb; 14(2):939-947. PubMed ID: 29227686
    [TBL] [Abstract][Full Text] [Related]  

  • 22. Improved semiconductor lattice parameters and band gaps from a middle-range screened hybrid exchange functional.
    Lucero MJ; Henderson TM; Scuseria GE
    J Phys Condens Matter; 2012 Apr; 24(14):145504. PubMed ID: 22417942
    [TBL] [Abstract][Full Text] [Related]  

  • 23. A new generalized Kohn-Sham method for fundamental band-gaps in solids.
    Eisenberg HR; Baer R
    Phys Chem Chem Phys; 2009 Jun; 11(22):4674-80. PubMed ID: 19475189
    [TBL] [Abstract][Full Text] [Related]  

  • 24. Semiconducting transition metal oxides.
    Lany S
    J Phys Condens Matter; 2015 Jul; 27(28):283203. PubMed ID: 26126022
    [TBL] [Abstract][Full Text] [Related]  

  • 25. Customizing PBE exchange-correlation functionals: a comprehensive approach for band gap prediction in diverse semiconductors.
    Bhattacharjee S; Koshi NA; Lee SC
    Phys Chem Chem Phys; 2024 Oct; 26(41):26443-26452. PubMed ID: 39392109
    [TBL] [Abstract][Full Text] [Related]  

  • 26. Magnetic Exchange Couplings from Semilocal Functionals Evaluated Nonself-Consistently on Hybrid Densities: Insights on Relative Importance of Exchange, Correlation, and Delocalization.
    Phillips JJ; Peralta JE
    J Chem Theory Comput; 2012 Sep; 8(9):3147-58. PubMed ID: 26605726
    [TBL] [Abstract][Full Text] [Related]  

  • 27. Ionization potentials of semiconductors from first-principles.
    Jiang H; Shen YC
    J Chem Phys; 2013 Oct; 139(16):164114. PubMed ID: 24182011
    [TBL] [Abstract][Full Text] [Related]  

  • 28. The AM05 density functional applied to solids.
    Mattsson AE; Armiento R; Paier J; Kresse G; Wills JM; Mattsson TR
    J Chem Phys; 2008 Feb; 128(8):084714. PubMed ID: 18315079
    [TBL] [Abstract][Full Text] [Related]  

  • 29. Accurate screened exchange band structures for the transition metal monoxides MnO, FeO, CoO and NiO.
    Gillen R; Robertson J
    J Phys Condens Matter; 2013 Apr; 25(16):165502. PubMed ID: 23553489
    [TBL] [Abstract][Full Text] [Related]  

  • 30. Structure and properties of metal-exchanged zeolites studied using gradient-corrected and hybrid functionals. III. Energetics and vibrational spectroscopy of adsorbates.
    Göltl F; Hafner J
    J Chem Phys; 2012 Feb; 136(6):064503. PubMed ID: 22360191
    [TBL] [Abstract][Full Text] [Related]  

  • 31. Comparative studies of the spectroscopy of CuCl2: DFT versus standard ab initio approaches.
    Ramírez-Solís A; Poteau R; Vela A; Daudey JP
    J Chem Phys; 2005 Apr; 122(16):164306. PubMed ID: 15945683
    [TBL] [Abstract][Full Text] [Related]  

  • 32. Why are time-dependent density functional theory excitations in solids equal to band structure energy gaps for semilocal functionals, and how does nonlocal Hartree-Fock-type exchange introduce excitonic effects?
    Izmaylov AF; Scuseria GE
    J Chem Phys; 2008 Jul; 129(3):034101. PubMed ID: 18647010
    [TBL] [Abstract][Full Text] [Related]  

  • 33. Comparing LDA-1/2, HSE03, HSE06 and G₀W₀ approaches for band gap calculations of alloys.
    Pela RR; Marques M; Teles LK
    J Phys Condens Matter; 2015 Dec; 27(50):505502. PubMed ID: 26609566
    [TBL] [Abstract][Full Text] [Related]  

  • 34. Accurate band gaps from exchange potentials designed from a cuspless hydrogen density-based exchange hole model.
    Patra A; Patra B; Samal P
    Phys Chem Chem Phys; 2022 Jun; 24(22):13633-13640. PubMed ID: 35611605
    [TBL] [Abstract][Full Text] [Related]  

  • 35. The effects of screening length in the non-local screened-exchange functional.
    Guo Y; Robertson J; Clark SJ
    J Phys Condens Matter; 2015 Jan; 27(2):025501. PubMed ID: 25524902
    [TBL] [Abstract][Full Text] [Related]  

  • 36. Accurate quasiparticle spectra from self-consistent GW calculations with vertex corrections.
    Shishkin M; Marsman M; Kresse G
    Phys Rev Lett; 2007 Dec; 99(24):246403. PubMed ID: 18233465
    [TBL] [Abstract][Full Text] [Related]  

  • 37. Efficient band gap prediction for solids.
    Chan MK; Ceder G
    Phys Rev Lett; 2010 Nov; 105(19):196403. PubMed ID: 21231189
    [TBL] [Abstract][Full Text] [Related]  

  • 38. Analytic derivatives for perturbatively corrected "double hybrid" density functionals: theory, implementation, and applications.
    Neese F; Schwabe T; Grimme S
    J Chem Phys; 2007 Mar; 126(12):124115. PubMed ID: 17411116
    [TBL] [Abstract][Full Text] [Related]  

  • 39. All-electron exact exchange treatment of semiconductors: effect of core-valence interaction on band-gap and d-band position.
    Sharma S; Dewhurst JK; Ambrosch-Draxl C
    Phys Rev Lett; 2005 Sep; 95(13):136402. PubMed ID: 16197158
    [TBL] [Abstract][Full Text] [Related]  

  • 40. Assessing model-dielectric-dependent hybrid functionals on the antiferromagnetic transition-metal monoxides MnO, FeO, CoO, and NiO.
    Liu P; Franchini C; Marsman M; Kresse G
    J Phys Condens Matter; 2020 Jan; 32(1):015502. PubMed ID: 31484169
    [TBL] [Abstract][Full Text] [Related]  

    [Previous]   [Next]    [New Search]
    of 26.