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 *

447 related articles for article (PubMed ID: 18855434)

  • 1. Characterization of the high-pressure structural transition and thermodynamic properties in sodium chloride: a computational investigation on the basis of the density functional theory.
    Lu C; Kuang XY; Zhu QS
    J Phys Chem B; 2008 Nov; 112(44):13898-905. PubMed ID: 18855434
    [TBL] [Abstract][Full Text] [Related]  

  • 2. The phase transition, and elastic and thermodynamic properties of CaS derived from first-principles calculations.
    Guo YD; Yang ZJ; Gao QH; Liu ZJ; Dai W
    J Phys Condens Matter; 2008 Mar; 20(11):115203. PubMed ID: 21694220
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Theoretical investigation on the structural and thermodynamic properties of FeSe at high pressure and high temperature.
    Lu C; Yang XQ; Zhu CY; Kuang XY
    Dalton Trans; 2012 Aug; 41(32):9781-8. PubMed ID: 22790848
    [TBL] [Abstract][Full Text] [Related]  

  • 4. First-principles study of structural and elastic properties of monoclinic and orthorhombic BiMnO3.
    Mei ZG; Shang SL; Wang Y; Liu ZK
    J Phys Condens Matter; 2010 Jul; 22(29):295404. PubMed ID: 21399306
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Structural, electronic, bonding, and elastic properties of NH3BH3: a density functional study.
    Lingam ChB; Babu KR; Tewari SP; Vaitheeswaran G
    J Comput Chem; 2011 Jun; 32(8):1734-42. PubMed ID: 21425297
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Cu₂O behavior under pressure: an ab initio study.
    Cortona P; Mebarki M
    J Phys Condens Matter; 2011 Feb; 23(4):045502. PubMed ID: 21406887
    [TBL] [Abstract][Full Text] [Related]  

  • 7. First-principles calculations of mechanical and thermodynamic properties of tetragonal Be
    Liu X; Feng Q; Tang B; Zheng J; Zheng Z; Zhou W; Tian J; Wang J
    RSC Adv; 2019 Feb; 9(10):5302-5312. PubMed ID: 35515957
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Phase transition and elastic constants of zirconium from first-principles calculations.
    Hao YJ; Zhang L; Chen XR; Li YH; He HL
    J Phys Condens Matter; 2008 Jun; 20(23):235230. PubMed ID: 21694321
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Ab initio study of the elastic properties of single and polycrystal TiO(2), ZrO(2) and HfO(2) in the cotunnite structure.
    Caravaca MA; Miño JC; Pérez VJ; Casali RA; Ponce CA
    J Phys Condens Matter; 2009 Jan; 21(1):015501. PubMed ID: 21817222
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Physical properties of thallium-tellurium based thermoelectric compounds using first-principles simulations.
    Tao X; Jund P; Viennois R; Tédenac JC
    J Phys Chem A; 2011 Aug; 115(31):8761-6. PubMed ID: 21736349
    [TBL] [Abstract][Full Text] [Related]  

  • 11. First-principles study of phase transition, elastic and thermodynamic properties of ZnSe at high pressure.
    Yang T; Zhu X; Ji J; Wang J
    Sci Rep; 2020 Feb; 10(1):3265. PubMed ID: 32094411
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Characterization of the high-pressure structures and phase transformations in SnO2. A density functional theory study.
    Gracia L; Beltrán A; Andrés J
    J Phys Chem B; 2007 Jun; 111(23):6479-85. PubMed ID: 17516672
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Electronic structure, optical properties and the mechanism of the B3-B8 phase transition of BeSe: insights from hybrid functionals, lattice dynamics and NPH molecular dynamics.
    Dutta R; Alptekin S; Mandal N
    J Phys Condens Matter; 2013 Mar; 25(12):125401. PubMed ID: 23449396
    [TBL] [Abstract][Full Text] [Related]  

  • 14. First-principles calculations of elastic and electronic properties of NbB(2) under pressure.
    Li XF; Ji GF; Zhao F; Chen XR; Alfè D
    J Phys Condens Matter; 2009 Jan; 21(2):025505. PubMed ID: 21813982
    [TBL] [Abstract][Full Text] [Related]  

  • 15. First-principles study of the elastic and thermodynamic properties of CaSiO(3) perovskite.
    Liu ZJ; Sun XW; Chen QF; Cai LC; Wu HY; Ge SH
    J Phys Condens Matter; 2007 Jun; 19(24):246103. PubMed ID: 21694039
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Modeling bulk and surface Pt using the "Gaussian and plane wave" density functional theory formalism: validation and comparison to k-point plane wave calculations.
    Santarossa G; Vargas A; Iannuzzi M; Pignedoli CA; Passerone D; Baiker A
    J Chem Phys; 2008 Dec; 129(23):234703. PubMed ID: 19102548
    [TBL] [Abstract][Full Text] [Related]  

  • 17. 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]  

  • 18. Structural, mechanical and electronic properties of 3d transition metal nitrides in cubic zincblende, rocksalt and cesium chloride structures: a first-principles investigation.
    Liu ZT; Zhou X; Khare SV; Gall D
    J Phys Condens Matter; 2014 Jan; 26(2):025404. PubMed ID: 24305607
    [TBL] [Abstract][Full Text] [Related]  

  • 19. High-pressure study of lithium azide from density-functional calculations.
    Babu KR; Lingam ChB; Tewari SP; Vaitheeswaran G
    J Phys Chem A; 2011 May; 115(17):4521-9. PubMed ID: 21486056
    [TBL] [Abstract][Full Text] [Related]  

  • 20. Lithium adsorption on graphite from density functional theory calculations.
    Valencia F; Romero AH; Ancilotto F; Silvestrelli PL
    J Phys Chem B; 2006 Aug; 110(30):14832-41. PubMed ID: 16869593
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 23.