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 *

125 related articles for article (PubMed ID: 36805343)

  • 21. Diffusion Barriers for Carbon Monoxide on the Cu(001) Surface Using Many-Body Perturbation Theory and Various Density Functionals.
    Wei Z; Göltl F; Sautet P
    J Chem Theory Comput; 2021 Dec; 17(12):7862-7872. PubMed ID: 34812624
    [TBL] [Abstract][Full Text] [Related]  

  • 22. Theoretical investigation of adsorption of molecular oxygen on small copper clusters.
    Yuan X; Liu L; Wang X; Yang M; Jackson KA; Jellinek J
    J Phys Chem A; 2011 Aug; 115(31):8705-12. PubMed ID: 21732667
    [TBL] [Abstract][Full Text] [Related]  

  • 23. Ab initio calculations for the Zn 2s and 2p core level binding energies in Zn oxo compounds and ZnO.
    Rössler N; Kotsis K; Staemmler V
    Phys Chem Chem Phys; 2006 Feb; 8(6):697-706. PubMed ID: 16482309
    [TBL] [Abstract][Full Text] [Related]  

  • 24. ab initio study of oxygen vacancy effects on structural, electronic and thermoelectric behavior of AZr
    Khera EA; Ullah H; Imran M; Niaz NA; Hussain F; Khalil RMA; Resheed U; Rana AM; Hussain MI; Mahata C; Kim S
    J Mol Graph Model; 2021 Mar; 103():107825. PubMed ID: 33429230
    [TBL] [Abstract][Full Text] [Related]  

  • 25. Band Gap Opening in Borophene/GaN and Borophene/ZnO Van der Waals Heterostructures Using Axial Deformation: First-Principles Study.
    Slepchenkov MM; Kolosov DA; Nefedov IS; Glukhova OE
    Materials (Basel); 2022 Dec; 15(24):. PubMed ID: 36556727
    [TBL] [Abstract][Full Text] [Related]  

  • 26. Modulation effects of S vacancy and Mo edge on the adsorption and dissociation behaviors of toxic gas (H
    Huang M; Dinesh A; Wu S
    Phys Chem Chem Phys; 2021 Jul; 23(28):15364-15373. PubMed ID: 34254618
    [TBL] [Abstract][Full Text] [Related]  

  • 27. Ab initio calculations of the reaction pathways for methane decomposition over the Cu (111) surface.
    Gajewski G; Pao CW
    J Chem Phys; 2011 Aug; 135(6):064707. PubMed ID: 21842949
    [TBL] [Abstract][Full Text] [Related]  

  • 28. Properties of real metallic surfaces: Effects of density functional semilocality and van der Waals nonlocality.
    Patra A; Bates JE; Sun J; Perdew JP
    Proc Natl Acad Sci U S A; 2017 Oct; 114(44):E9188-E9196. PubMed ID: 29042509
    [TBL] [Abstract][Full Text] [Related]  

  • 29. 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]  

  • 30. Adsorption of alkylamines on Cu surfaces: identifying ideal capping molecules using first-principles calculations.
    Chen Z; Fichthorn KA
    Nanoscale; 2021 Nov; 13(44):18536-18545. PubMed ID: 34730161
    [TBL] [Abstract][Full Text] [Related]  

  • 31. Adsorption and splitting of H2S on 2D-ZnO(1-x)N(y): first-principles analysis.
    Kouser S; Waghmare UV; Tit N
    Phys Chem Chem Phys; 2014 Jun; 16(22):10719-26. PubMed ID: 24756555
    [TBL] [Abstract][Full Text] [Related]  

  • 32. A first-principles density functional study of chlorophenol adsorption on Cu2O(110):CuO.
    Altarawneh M; Radny MW; Smith PV; Mackie JC; Kennedy EM; Dlugogorski BZ; Soon A; Stampfl C
    J Chem Phys; 2009 May; 130(18):184505. PubMed ID: 19449934
    [TBL] [Abstract][Full Text] [Related]  

  • 33. 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]  

  • 34. First-principles investigation of methanethiol adsorption and dissociation mechanisms on the high-Miller-index vicinal surface Cu(4 1 0).
    Raouafi F; Seydou M; Lassoued K; Taleb A; Diawara B
    J Phys Condens Matter; 2016 May; 28(17):175001. PubMed ID: 27028163
    [TBL] [Abstract][Full Text] [Related]  

  • 35. Proceedings of the Second Workshop on Theory meets Industry (Erwin-Schrödinger-Institute (ESI), Vienna, Austria, 12-14 June 2007).
    Hafner J
    J Phys Condens Matter; 2008 Feb; 20(6):060301. PubMed ID: 21693862
    [TBL] [Abstract][Full Text] [Related]  

  • 36. 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]  

  • 37. First-principles study of electronic structure and magnetic properties of L1
    Aledealat K; Aladerah B; Obeidat A; Gharaibeh M
    Heliyon; 2021 Dec; 7(12):e08639. PubMed ID: 35024483
    [TBL] [Abstract][Full Text] [Related]  

  • 38. Ab initio theoretical study of the interactions between CFCl3 and SO2.
    Diao KS; Wang F; Wang HJ
    Bull Environ Contam Toxicol; 2010 Feb; 84(2):170-4. PubMed ID: 19943033
    [TBL] [Abstract][Full Text] [Related]  

  • 39. Novel Van Der Waals Heterostructures Based on Borophene, Graphene-like GaN and ZnO for Nanoelectronics: A First Principles Study.
    Slepchenkov MM; Kolosov DA; Glukhova OE
    Materials (Basel); 2022 Jun; 15(12):. PubMed ID: 35744141
    [TBL] [Abstract][Full Text] [Related]  

  • 40. DFT Study of N
    Liu Z; Cheng XR; Yang YM; Jia HZ; Bai BQ; Zhao L
    Materials (Basel); 2019 Aug; 12(16):. PubMed ID: 31426324
    [TBL] [Abstract][Full Text] [Related]  

    [Previous]   [Next]    [New Search]
    of 7.