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 *

140 related articles for article (PubMed ID: 32275782)

  • 1. Substitutional carbon defects in silicon: A quantum mechanical characterization through the infrared and Raman spectra.
    Gentile FS; Platonenko A; El-Kelany KE; Rérat M; D'Arco P; Dovesi R
    J Comput Chem; 2020 Jun; 41(17):1638-1644. PubMed ID: 32275782
    [TBL] [Abstract][Full Text] [Related]  

  • 2. Interstitial carbon defects in silicon. A quantum mechanical characterization through the infrared and Raman spectra.
    Platonenko A; Gentile FS; Pascale F; D'Arco P; Dovesi R
    J Comput Chem; 2021 May; 42(12):806-817. PubMed ID: 33648024
    [TBL] [Abstract][Full Text] [Related]  

  • 3. Nitrogen substitutional defects in silicon. A quantum mechanical investigation of the structural, electronic and vibrational properties.
    Platonenko A; Gentile FS; Pascale F; Ferrari AM; D'Amore M; Dovesi R
    Phys Chem Chem Phys; 2019 Oct; 21(37):20939-20950. PubMed ID: 31524895
    [TBL] [Abstract][Full Text] [Related]  

  • 4. Oxygen and vacancy defects in silicon. A quantum mechanical characterization through the IR and Raman spectra.
    Platonenko A; Colasuonno F; Gentile FS; Pascale F; Dovesi R
    J Chem Phys; 2021 May; 154(17):174707. PubMed ID: 34241078
    [TBL] [Abstract][Full Text] [Related]  

  • 5. The V + I defects in diamond: An ab initio investigation of the electronic structure, of the Raman and IR spectra, and of their possible recombination.
    Salustro S; Nöel Y; Zicovich-Wilson CM; Olivero P; Dovesi R
    J Chem Phys; 2016 Nov; 145(18):184701. PubMed ID: 27846678
    [TBL] [Abstract][Full Text] [Related]  

  • 6. The spectroscopic characterization of interstitial oxygen in bulk silicon: A quantum mechanical simulation.
    Gentile FS; Difalco A; Pascale F; Salustro S; Mackrodt W; Dovesi R
    J Chem Phys; 2020 Feb; 152(5):054502. PubMed ID: 32035443
    [TBL] [Abstract][Full Text] [Related]  

  • 7. The VN
    Gentile FS; Salustro S; Causà M; Erba A; Carbonniére P; Dovesi R
    Phys Chem Chem Phys; 2017 Aug; 19(33):22221-22229. PubMed ID: 28799588
    [TBL] [Abstract][Full Text] [Related]  

  • 8. Vibrational spectroscopy of hydrogens in diamond: a quantum mechanical treatment.
    Gentile FS; Salustro S; Desmarais JK; Ferrari AM; D'Arco P; Dovesi R
    Phys Chem Chem Phys; 2018 May; 20(17):11930-11940. PubMed ID: 29667679
    [TBL] [Abstract][Full Text] [Related]  

  • 9. Characterization of the B-Center Defect in Diamond through the Vibrational Spectrum: A Quantum-Mechanical Approach.
    Salustro S; Ferrari AM; Gentile FS; Desmarais JK; Rérat M; Dovesi R
    J Phys Chem A; 2018 Jan; 122(2):594-600. PubMed ID: 29235862
    [TBL] [Abstract][Full Text] [Related]  

  • 10. Interstitial nitrogen atoms in diamond. A quantum mechanical investigation of its electronic and vibrational properties.
    Salustro S; Pascale F; Mackrodt WC; Ravoux C; Erba A; Dovesi R
    Phys Chem Chem Phys; 2018 Jun; 20(24):16615-16624. PubMed ID: 29873356
    [TBL] [Abstract][Full Text] [Related]  

  • 11. The A-center defect in diamond: quantum mechanical characterization through the infrared spectrum.
    Salustro S; Sansone G; Zicovich-Wilson CM; Noël Y; Maschio L; Dovesi R
    Phys Chem Chem Phys; 2017 Jun; 19(22):14478-14485. PubMed ID: 28534569
    [TBL] [Abstract][Full Text] [Related]  

  • 12. Quantum-mechanical ab initio simulation of the Raman and IR spectra of Fe3Al2Si3O12 almandine.
    Ferrari AM; Valenzano L; Meyer A; Orlando R; Dovesi R
    J Phys Chem A; 2009 Oct; 113(42):11289-94. PubMed ID: 19788292
    [TBL] [Abstract][Full Text] [Related]  

  • 13. Raman spectroscopic features of the neutral vacancy in diamond from ab initio quantum-mechanical calculations.
    Baima J; Zelferino A; Olivero P; Erba A; Dovesi R
    Phys Chem Chem Phys; 2016 Jan; 18(3):1961-8. PubMed ID: 26686374
    [TBL] [Abstract][Full Text] [Related]  

  • 14. Infrared and Raman spectroscopic features of the self-interstitial defect in diamond from exact-exchange hybrid DFT calculations.
    Salustro S; Erba A; Zicovich-Wilson CM; Nöel Y; Maschio L; Dovesi R
    Phys Chem Chem Phys; 2016 Aug; 18(31):21288-95. PubMed ID: 27326546
    [TBL] [Abstract][Full Text] [Related]  

  • 15. Calculational Raman spectra investigation of nitrogen-hyperdoped silicon formed in different conditions.
    Dong X; Wang Y; Song X
    J Phys Condens Matter; 2020 Mar; 32(11):115701. PubMed ID: 31746777
    [TBL] [Abstract][Full Text] [Related]  

  • 16. Microscopic Characterization of Oxygen Defects in Diamond as Models for N3 and OK1 Defects: A Comparison of Calculated and Experimental Electron Paramagnetic Resonance Data.
    El-Kelany KE; Ferrari AM; Gentile FS; Dovesi R
    J Phys Chem A; 2020 Oct; 124(40):8263-8272. PubMed ID: 32933259
    [TBL] [Abstract][Full Text] [Related]  

  • 17. Spectra and structure of silicon containing compounds. XXXII. Raman and infrared spectra, conformational stability, vibrational assignment and ab initio calculations of n-propylsilane-d0 and Si-d3.
    Durig JR; Pan C; Guirgis GA
    Spectrochim Acta A Mol Biomol Spectrosc; 2003 Mar; 59(5):979-1002. PubMed ID: 12633715
    [TBL] [Abstract][Full Text] [Related]  

  • 18. Interstitial defects in diamond: A quantum mechanical simulation of their EPR constants and vibrational spectra.
    Colasuonno F; Gentile FS; Mackrodt W; Ferrari AM; Platonenko A; Dovesi R
    J Chem Phys; 2020 Jul; 153(2):024119. PubMed ID: 32668934
    [TBL] [Abstract][Full Text] [Related]  

  • 19. Raman spectrum of pyrope garnet. A quantum mechanical simulation of frequencies, intensities, and isotope shifts.
    Maschio L; Kirtman B; Salustro S; Zicovich-Wilson CM; Orlando R; Dovesi R
    J Phys Chem A; 2013 Nov; 117(45):11464-71. PubMed ID: 24124910
    [TBL] [Abstract][Full Text] [Related]  

  • 20. The vibrational spectrum of alpha-AlOOH diaspore: an ab initio study with the CRYSTAL code.
    Demichelis R; Noel Y; Civalleri B; Roetti C; Ferrero M; Dovesi R
    J Phys Chem B; 2007 Aug; 111(31):9337-46. PubMed ID: 17629324
    [TBL] [Abstract][Full Text] [Related]  

    [Next]    [New Search]
    of 7.