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 *

265 related articles for article (PubMed ID: 26609581)

  • 1. Regularized Gradient Expansion for Atoms, Molecules, and Solids.
    Ruzsinszky A; Csonka GI; Scuseria GE
    J Chem Theory Comput; 2009 Apr; 5(4):763-9. PubMed ID: 26609581
    [TBL] [Abstract][Full Text] [Related]  

  • 2. A meta-GGA Made Free of the Order of Limits Anomaly.
    Ruzsinszky A; Sun J; Xiao B; Csonka GI
    J Chem Theory Comput; 2012 Jun; 8(6):2078-87. PubMed ID: 26593840
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Construction of a generalized gradient approximation by restoring the density-gradient expansion and enforcing a tight Lieb-Oxford bound.
    Zhao Y; Truhlar DG
    J Chem Phys; 2008 May; 128(18):184109. PubMed ID: 18532801
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Performance of a nonempirical meta-generalized gradient approximation density functional for excitation energies.
    Tao J; Tretiak S; Zhu JX
    J Chem Phys; 2008 Feb; 128(8):084110. PubMed ID: 18315036
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Workhorse semilocal density functional for condensed matter physics and quantum chemistry.
    Perdew JP; Ruzsinszky A; Csonka GI; Constantin LA; Sun J
    Phys Rev Lett; 2009 Jul; 103(2):026403. PubMed ID: 19659225
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Assessing the performance of the recent meta-GGA density functionals for describing the lattice constants, bulk moduli, and cohesive energies of alkali, alkaline-earth, and transition metals.
    Jana S; Sharma K; Samal P
    J Chem Phys; 2018 Oct; 149(16):164703. PubMed ID: 30384757
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Meta-generalized gradient approximation: explanation of a realistic nonempirical density functional.
    Perdew JP; Tao J; Staroverov VN; Scuseria GE
    J Chem Phys; 2004 Apr; 120(15):6898-911. PubMed ID: 15267588
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Prescription for the design and selection of density functional approximations: more constraint satisfaction with fewer fits.
    Perdew JP; Ruzsinszky A; Tao J; Staroverov VN; Scuseria GE; Csonka GI
    J Chem Phys; 2005 Aug; 123(6):62201. PubMed ID: 16122287
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Bulk Properties of Transition Metals: A Challenge for the Design of Universal Density Functionals.
    Janthon P; Luo SA; Kozlov SM; Viñes F; Limtrakul J; Truhlar DG; Illas F
    J Chem Theory Comput; 2014 Sep; 10(9):3832-9. PubMed ID: 26588528
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Binding energy curves from nonempirical density functionals. I. Covalent bonds in closed-shell and radical molecules.
    Ruzsinszky A; Perdew JP; Csonka GI
    J Phys Chem A; 2005 Dec; 109(48):11006-14. PubMed ID: 16331944
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Testing the TPSS meta-generalized-gradient-approximation exchange-correlation functional in calculations of transition states and reaction barriers.
    Kanai Y; Wang X; Selloni A; Car R
    J Chem Phys; 2006 Dec; 125(23):234104. PubMed ID: 17190544
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Jacob's Ladder as Sketched by Escher: Assessing the Performance of Broadly Used Density Functionals on Transition Metal Surface Properties.
    Vega L; Ruvireta J; Viñes F; Illas F
    J Chem Theory Comput; 2018 Jan; 14(1):395-403. PubMed ID: 29182868
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Performance of meta-GGA Functionals on General Main Group Thermochemistry, Kinetics, and Noncovalent Interactions.
    Hao P; Sun J; Xiao B; Ruzsinszky A; Csonka GI; Tao J; Glindmeyer S; Perdew JP
    J Chem Theory Comput; 2013 Jan; 9(1):355-63. PubMed ID: 26589038
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Employing Range Separation on the meta-GGA Rung: New Functional Suitable for Both Covalent and Noncovalent Interactions.
    Modrzejewski M; Hapka M; Chalasinski G; Szczesniak MM
    J Chem Theory Comput; 2016 Aug; 12(8):3662-73. PubMed ID: 27428668
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Test of a nonempirical density functional: short-range part of the van der Waals interaction in rare-gas dimers.
    Tao J; Perdew JP
    J Chem Phys; 2005 Mar; 122(11):114102. PubMed ID: 15836196
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Double-hybrid density-functional theory with meta-generalized-gradient approximations.
    Souvi SM; Sharkas K; Toulouse J
    J Chem Phys; 2014 Feb; 140(8):084107. PubMed ID: 24588148
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Influence of the exchange-correlation functional on the quasi-harmonic lattice dynamics of II-VI semiconductors.
    Skelton JM; Tiana D; Parker SC; Togo A; Tanaka I; Walsh A
    J Chem Phys; 2015 Aug; 143(6):064710. PubMed ID: 26277159
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Variable Lieb-Oxford bound satisfaction in a generalized gradient exchange-correlation functional.
    Vela A; Medel V; Trickey SB
    J Chem Phys; 2009 Jun; 130(24):244103. PubMed ID: 19566138
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Small clusters of aluminum and tin: highly correlated calculations and validation of density functional procedures.
    Drebov N; Ahlrichs R
    J Chem Phys; 2011 Mar; 134(12):124308. PubMed ID: 21456663
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Binding energy curves from nonempirical density functionals II. van der Waals bonds in rare-gas and alkaline-earth diatomics.
    Ruzsinszky A; Perdew JP; Csonka GI
    J Phys Chem A; 2005 Dec; 109(48):11015-21. PubMed ID: 16331945
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 14.