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 *

239 related articles for article (PubMed ID: 26596294)

  • 1. Evaluating the Performance of DFT Functionals in Assessing the Interaction Energy and Ground-State Charge Transfer of Donor/Acceptor Complexes: Tetrathiafulvalene-Tetracyanoquinodimethane (TTF-TCNQ) as a Model Case.
    Sini G; Sears JS; Brédas JL
    J Chem Theory Comput; 2011 Mar; 7(3):602-9. PubMed ID: 26596294
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Why are the Interaction Energies of Charge-Transfer Complexes Challenging for DFT?
    Steinmann SN; Piemontesi C; Delachat A; Corminboeuf C
    J Chem Theory Comput; 2012 May; 8(5):1629-40. PubMed ID: 26593656
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Ab Initio Modeling of Donor-Acceptor Interactions and Charge-Transfer Excitations in Molecular Complexes: The Case of Terthiophene-Tetracyanoquinodimethane.
    Aragó J; Sancho-García JC; Ortí E; Beljonne D
    J Chem Theory Comput; 2011 Jul; 7(7):2068-77. PubMed ID: 26606478
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Description of intermolecular charge transfer with subsystem density-functional theory.
    Schulz A; Jacob CR
    J Chem Phys; 2019 Oct; 151(13):131103. PubMed ID: 31594348
    [TBL] [Abstract][Full Text] [Related]  

  • 5. Theoretical study on the charge transfer mechanism at donor/acceptor interface: Why TTF/TCNQ is inadaptable to photovoltaics?
    Li SB; Geng Y; Duan YA; Sun GY; Zhang M; Qiu YQ; Su ZM
    J Chem Phys; 2016 Dec; 145(24):244705. PubMed ID: 28049323
    [TBL] [Abstract][Full Text] [Related]  

  • 6. Calculating Electron-Transfer Coupling with Density Functional Theory: The Long-Range-Corrected Density Functionals.
    You ZQ; Hung YC; Hsu CP
    J Phys Chem B; 2015 Jun; 119(24):7480-90. PubMed ID: 25599406
    [TBL] [Abstract][Full Text] [Related]  

  • 7. Understanding the Charge Transfer at the Interface of Electron Donors and Acceptors: TTF-TCNQ as an Example.
    Park C; Atalla V; Smith S; Yoon M
    ACS Appl Mater Interfaces; 2017 Aug; 9(32):27266-27272. PubMed ID: 28621127
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Donor-acceptor complex of a new bis-TTF donor containing a pyridine diester spacer with TCNQ as the acceptor: a disappointing system.
    Kaboub L; Fabre JM; Vendier L; Legros JP
    Acta Crystallogr C; 2010 Aug; 66(Pt 8):o429-32. PubMed ID: 20679723
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Description of the Charge Transfer States at the Pentacene/C60 Interface: Combining Range-Separated Hybrid Functionals with the Polarizable Continuum Model.
    Zheng Z; Brédas JL; Coropceanu V
    J Phys Chem Lett; 2016 Jul; 7(13):2616-21. PubMed ID: 27338105
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Barrier height formation in organic blends/metal interfaces: case of tetrathiafulvalene-tetracyanoquinodimethane/Au(111).
    Martínez JI; Abad E; Beltrán JI; Flores F; Ortega J
    J Chem Phys; 2013 Dec; 139(21):214706. PubMed ID: 24320393
    [TBL] [Abstract][Full Text] [Related]  

  • 11. Charge transfer in hybrid organic-inorganic PbS nanocrystal systems.
    Nordin MN; Bourdakos KN; Curry RJ
    Phys Chem Chem Phys; 2010 Jul; 12(27):7371-7. PubMed ID: 20464032
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Assessment of the performance of long-range-corrected density functionals for calculating the absorption spectra of silver clusters.
    Rabilloud F
    J Phys Chem A; 2013 May; 117(20):4267-78. PubMed ID: 23638637
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Dynamic self-assembly of charge-transfer nanofibers of tetrathiafulvalene derivatives with F4TCNQ.
    Jain A; Rao KV; Mogera U; Sagade AA; George SJ
    Chemistry; 2011 Oct; 17(44):12355-61. PubMed ID: 21922580
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Understanding the Resonance Raman Scattering of Donor-Acceptor Complexes using Long-Range Corrected DFT.
    Silverstein DW; Jensen L
    J Chem Theory Comput; 2010 Sep; 6(9):2845-55. PubMed ID: 26616085
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Structural, Magnetic and DFT studies on a Charge-Transfer Salt of a Tetrathiafulvalenepyridyl-(1,5-diisopropyl) verdazyl Diradical Cation.
    Venneri S; Wilson J; Rawson JM; Pilkington M
    Chempluschem; 2015 Nov; 80(11):1624-1633. PubMed ID: 31973366
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Semilocal and hybrid density embedding calculations of ground-state charge-transfer complexes.
    Laricchia S; Fabiano E; Della Sala F
    J Chem Phys; 2013 Mar; 138(12):124112. PubMed ID: 23556714
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Comparative electrochemical and photophysical studies of tetrathiafulvalene-annulated porphyrins and their Zn(II) complexes: the effect of metalation and structural variation.
    Jana A; Ishida M; Kwak K; Sung YM; Kim DS; Lynch VM; Lee D; Kim D; Sessler JL
    Chemistry; 2013 Jan; 19(1):338-49. PubMed ID: 23180557
    [TBL] [Abstract][Full Text] [Related]  

  • 18. On describing the optoelectronic characteristics of poly(benzodithiophene-co-quinoxaline)-fullerene complexes: the influence of optimally tuned density functionals.
    Kastinen T; Niskanen M; Risko C; Cramariuc O; Hukka TI
    Phys Chem Chem Phys; 2016 Oct; 18(39):27654-27670. PubMed ID: 27722580
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Multiconfiguration Pair-Density Functional Theory Outperforms Kohn-Sham Density Functional Theory and Multireference Perturbation Theory for Ground-State and Excited-State Charge Transfer.
    Ghosh S; Sonnenberger AL; Hoyer CE; Truhlar DG; Gagliardi L
    J Chem Theory Comput; 2015 Aug; 11(8):3643-9. PubMed ID: 26574447
    [TBL] [Abstract][Full Text] [Related]  

  • 20. TD-DFT description of photoabsorption and electron transfer in a covalently bonded porphyrin-fullerene dyad.
    Cramariuc O; Hukka TI; Rantala TT; Lemmetyinen H
    J Phys Chem A; 2006 Nov; 110(45):12470-6. PubMed ID: 17091952
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 12.