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NCSU Scholarly Publications Repository (Search Again)

A growing collection of publications and full text of scholarly works by NC State faculty members, graduate students, and research staff.

Number of Publications: 49
Irving, Douglas Lee


Articles
Bryan, I., Bryan, Z., Washiyama, S., Reddy, P., Gaddy, B., Sarkar, B., Breckenridge, M. H., Guo, Q., Bobea, M., Tweedie, J., Mita, S., Irving, D., Collazo, R., & Sitar, Z. (2018). Doping and compensation in Al-rich AlGaN grown on single crystal AlN and sapphire by MOCVD. Applied Physics Letters, 112(6).

Bowes, P. C., Baker, J. N., Harris, J. S., Behrhorst, B. D., & Irving, D. L. (2018). Influence of impurities on the high temperature conductivity of SrTiO3. Applied Physics Letters, 112(2).

Harris, J. S., Baker, J. N., Gaddy, B. E., Bryan, I., Bryan, Z., Mirrielees, K. J., Reddy, P., Collazo, R., Sitar, Z., & Irving, D. L. (2018). On compensation in Si-doped AlN. Applied Physics Letters, 112(15).

Alden, D., Harris, J. S., Bryan, Z., Baker, J. N., Reddy, P., Mita, S., Callsen, G., Hoffmann, A., Irving, D. L., Collazo, R., & Sitar, Z. (2018). Point-defect nature of the ultraviolet absorption band in AIN. Physical Review Applied, 9(5).

Dycus, J. H., Mirrielees, K. J., Grimley, E. D., Kirste, R., Mita, S., Sitar, Z., Collazo, R., Irving, D. L., & LeBeau, J. M. (2018). Structure of ultrathin native oxides on III-nitride surfaces. ACS Applied Materials & Interfaces, 10(13), 10607-10611.

Li, X. Q., Schonecker, S., Li, W., Varga, L. K., Irving, D. L., & Vitos, L. (2018). Tensile and shear loading of four FCC high-entropy alloys: A first-principles study. Physical Review B, 97(9).

Tian, L. Y., Wang, G. S., Harris, J. S., Irving, D. L., Zhao, J. J., & Vitos, L. (2017). Alloying effect on the elastic properties of refractory high-entropy alloys. Materials & Design, 114, 243-252.

Baker, J. N., Bowes, P. C., Long, D. M., Moballegh, A., Harris, J. S., Dickey, E. C., & Irving, D. L. (2017). Defect mechanisms of coloration in Fe-doped SrTiO3 from first principles. Applied Physics Letters, 110(12).

Wang, J. J., Huang, H. B., Bayer, T. J. M., Moballegh, A., Cao, Y., Klein, A., Dickey, E. C., Irving, D. L., Randall, C. A., & Chen, L. Q. (2016). Defect chemistry and resistance degradation in Fe-doped SrTiO3 single crystal. Acta Materialia, 108, 229-240.

Niu, C., Zaddach, A. J., Koch, C. C., & Irving, D. L. (2016). First principles exploration of near-equiatomic NiFeCrCo high entropy alloys. Journal of Alloys and Compounds, 672, 510-520.

Xu, W. Z., Bowes, P. C., Grimley, E. D., Irving, D. L., & LeBeau, J. M. (2016). In-situ real-space imaging of single crystal surface reconstructions via electron microscopy. Applied Physics Letters, 109(20).

Zaddach, A. J., Niu, C., Oni, A. A., Fan, M., LeBeau, J. M., Irving, D. L., & Koch, C. C. (2016). Structure and magnetic properties of a multi-principal element Ni-Fe-Cr-Co-Zn-Mn alloy. Intermetallics, 68, 107-112.

Bayer, T. J. M., Wang, J. J., Carter, J. J., Moballegh, A., Baker, J., Irving, D. L., Dickey, E. C., Chen, L. Q., & Randall, C. A. (2016). The relation of electrical conductivity profiles and modulus data using the example of STO:Fe single crystals: A path to improve the model of resistance degradation. Acta Materialia, 117, 252-261.

Dycus, J. H., Harris, J. S., Sang, X. H., Fancher, C. M., Findlay, S. D., Oni, A. A., Chan, T. T. E., Koch, C. C., Jones, J. L., Allen, L. J., Irving, D. L., & LeBeau, J. M. (2015). Accurate nanoscale crystallography in real-space using scanning transmission electron microscopy. Microscopy and Microanalysis, 21(4), 946-952.

Sang, X. H., Grimley, E. D., Niu, C. N., Irving, D. L., & LeBeau, J. M. (2015). Direct observation of charge mediated lattice distortions in complex oxide solid solutions. Applied Physics Letters, 106(6).

Sachet, E., Shelton, C. T., Harris, J. S., Gaddy, B. E., Irving, D. L., Curtarolo, S., Donovan, B. F., Hopkins, P. E., Sharma, P. A., Sharma, A. L., Ihlefeld, J., Franzen, S., & Maria, J. P. (2015). Dysprosium-doped cadmium oxide as a gateway material for mid-infrared plasmonics. Nature Materials, 14(4), 414-420.

Lu, S. J., Mily, E. J., Irving, D. L., Maria, J. P., & Brenner, D. W. (2015). New method for extracting diffusion-controlled kinetics from differential scanning calorimetry: Application to energetic nanostructures. Journal of Physical Chemistry. C, 119(25), 14411-14418.

Niu, C., Zaddach, A. J., Oni, A. A., Sang, X., Hurt, J. W., LeBeau, J. M., Koch, C. C., & Irving, D. L. (2015). Spin-driven ordering of Cr in the equiatomic high entropy alloy NiFeCrCo. Applied Physics Letters, 106(16).

Youssef, K. M., Zaddach, A. J., Niu, C. N., Irving, D. L., & Koch, C. C. (2015). A novel low-density, high-hardness, high-entropy alloy with close-packed single-phase nanocrystalline structures. Materials Research Letters, 3(2), 95-99.

Bryan, Z., Bryan, I., Gaddy, B. E., Reddy, P., Hussey, L., Bobea, M., Guo, W., Hoffmann, M., Kirste, R., Tweedie, J., Gerhold, M., Irving, D. L., Sitar, Z., & Collazo, R. (2014). Fermi level control of compensating point defects during metalorganic chemical vapor deposition growth of Si-doped AlGaN. Applied Physics Letters, 105(22).

Gaddy, B. E., Paisley, E. A., Maria, J. P., & Irving, D. L. (2014). Overcoming the polarization catastrophe in the rocksalt oxides MgO and CaO. Physical Review. B, Condensed Matter and Materials Physics, 90(12).

Paisley, E. A., Gaddy, B. E., LeBeau, J. M., Shelton, C. T., Biegalski, M. D., Christen, H. M., Losego, M. D., Mita, S., Collazo, R., Sitar, Z., Irving, D. L., & Maria, J. P. (2014). Smooth cubic commensurate oxides on gallium nitride. Journal of Applied Physics, 115(6).

Gaddy, B. E., Bryan, Z., Bryan, I., Xie, J. Q., Dalmau, R., Moody, B., Kumagai, Y., Nagashima, T., Kubota, Y., Kinoshita, T., Koukitu, A., Kirste, R., Sitar, Z., Collazo, R., & Irving, D. L. (2014). The role of the carbon-silicon complex in eliminating deep ultraviolet absorption in AlN. Applied Physics Letters, 104(20).

Gaddy, B. E., Kingon, A. I., & Irving, D. L. (2013). Effects of alloying and local order in AuNi contacts for Ohmic radio frequency micro electro mechanical systems switches via multi-scale simulation. Journal of Applied Physics, 113(20).

Freeze, C. R., Ji, X. Y., Kingon, A. I., & Irving, D. L. (2013). Impact of Joule heating, roughness, and contaminants on the relative hardness of polycrystalline gold. Journal of Physics. Condensed Matter, 25(47).

Gaddy, B. E., Bryan, Z., Bryan, I., Kirste, R., Xie, J. Q., Dalmau, R., Moody, B., Kumagai, Y., Nagashima, T., Kubota, Y., Kinoshita, T., Koukitu, A., Sitar, Z., Collazo, R., & Irving, D. L. (2013). Vacancy compensation and related donor-acceptor pair recombination in bulk AlN. Applied Physics Letters, 103(16).

Collazo, R., Xie, J. Q., Gaddy, B. E., Bryan, Z., Kirste, R., Hoffmann, M., Dalmau, R., Moody, B., Kumagai, Y., Nagashima, T., Kubota, Y., Kinoshita, T., Koukitu, A., Irving, D. L., & Sitar, Z. (2012). On the origin of the 265 nm absorption band in AlN bulk crystals. Applied Physics Letters, 100(19).

Dongare, A. M., LaMattina, B., Irving, D. L., Rajendran, A. M., Zikry, M. A., & Brenner, D. W. (2012). An angular-dependent embedded atom method (A-EAM) interatomic potential to model thermodynamic and mechanical behavior of Al/Si composite materials. Modelling and Simulation in Materials Science and Engineering, 20(3).

Paisley, E. A., Losego, M. D., Gaddy, B. E., Tweedie, J. S., Collazo, R., Sitar, Z., Irving, D. L., Maria, J. P. (2011). Surfactant-enabled epitaxy through control of growth mode with chemical boundary conditions. Nature Communications, 2.

Crill, J. W., Ji, X., Irving, D. L., Brenner, D. W., & Padgett, C. W. (2010). Atomic and multi-scale modeling of non-equilibrium dynamics at metal-metal contacts. Modelling and Simulation in Materials Science and Engineering, 18(3).

Purohit, Y., Sun, L., Irving, D. L., Scattergood, R. O., & Brenner, D. W. (2010). Computational study of the impurity induced reduction of grain boundary energies in nano- and bi-crystalline Al-Pb alloys. Materials Science & Engineering. A, Structural Materials: Properties, Microstructure and Processing, 527(7-8), 1769-1775.

Irving, D. L., Padgett, C. W., & Brenner, D. W. (2009). Coupled molecular dynamics/continuum simulations of Joule heating and melting of isolated copper-aluminum asperity contacts. Modelling and Simulation in Materials Science and Engineering, 17(1).

Sun, L. P., Irving, D. L., Zikry, M. A., & Brenner, D. W. (2009). First-principles investigation of the structure and synergistic chemical bonding of Ag and Mg at the Al vertical bar Omega interface in a Al-Cu-Mg-Ag alloy. Acta Materialia, 57(12), 3522-3528.

Elkhodary, K., Sun, L. P., Irving, D. L., Brenner, D. W., Ravichandran, G., & Zikry, M. A. (2009). Integrated experimental, atomistic, and microstructurally based finite element investigation of the dynamic compressive behavior of 2139 aluminum. Journal of Applied Mechanics: Transactions of the ASME, 76(5).

Jang, S., Purohit, Y., Irving, D. L., Padgett, C., Brenner, D., & Scattergood, R. O. (2008). Influence of Pb segregation on the deformation of nanocrystalline Al: Insights from molecular simulations. Acta Materialia, 56(17), 4750-4761.

Irving, D. L., & Brenner, D. W. (2008). MEMS Lubrication: An atomistic perspective of a bound+ mobile lubricant'. Materials Research Society Symposium Proceedings, 1052, 29-34.

Purohit, Y., Irving, D. L., Scattergood, R. O., & Brenner, D. W. (2008). Prediction of Energies of <100> Tilt Boundaries in Al-Pb Alloy. Materials Research Society Symposium Proceedings, 1056E, 1056-HH01-1056-HH10.

Rezvanian, O., Brown, C., Zikry, M. A., Kingon, A. I., Krim, J., Irving, D. L., & Brenner, D. W. (2008). The role of creep in the time-dependent resistance of Ohmic gold contacts in radio frequency microelectromechanical system devices. Journal of Applied Physics, 104(2).

Irving, D. L., Devine, B. D., & Sinnott, S. B. (2007). Calculated Optical Absorption and Emissions from Poly p-Phenylene Oligomers. Journal of Luminescence, 126, 278.

Brenner, D. W., Irving, D. L., Kingon, A. I., & Krim, J. (2007). Multiscale analysis of liquid lubrication trends from industrial machines to micro-electrical-mechanical systems. Langmuir, 23(18), 9253-9257.

Irving, D. L., & Brenner, D. W. (2006). Diffusion on a self-assembled monolayer: Molecular modeling of a bound plus mobile lubricant. Journal of Physical Chemistry. B, Condensed Matter, Materials, Surfaces, Interfaces & Biophysical, 110(31), 15426-15431.

Irving, D. L., Sinnott, S. B., & Wood, R. F. (2006). Relative stabilities of Ag multilayers on GaAs and GaSb determined from ab initio calculations. Physical Review. B, Condensed Matter and Materials Physics, 74, 195403.

Abdelmaksoud, M., Lee, S. M., Padgett, C. W., Irving, D. L., Brenner, D. W., & Krim, J. (2006). STM, QCM, and the windshield wiper effect: A joint theoretical-experimental study of adsorbate mobility and lubrication at high sliding rates. Langmuir, 22(23), 9606-9609.

Chapters
Sinnott, S. B., Heo, S. J., Brenner, D. W., Harrison, J. A., & Irving, D. L. (2010). Computer Simulation of Nanometer-Scale Indentation and Friction'. In Bharat Bhushan (ed.), Handbook of Nanotechnology, Third Edition. (pp. 955-1012). New York: Springer.

Irving, Douglas L. (2010). Understanding Metal/Metal Electrical Contact Conductance from the Atomic to Continuum Scales. In Kenneth B. Lipkowitz (Ed.), Oxford: Wiley-Blackwell.

Conference Papers
Alden, D., Bryan, Z., Gaddy, B. E., Bryan, I., Callsen, G., Koukitu, A., Kumagai, Y., Hoffmann, A., Irving, D. L., Sitar, Z., & Collazo, R. (2016). On the origin of the 4.7 eV absorption and 2.8 eV emission bands in bulk AlN substrates. In Wide bandgap semiconductor materials and devices 17. (ECS Transactions, 72 5) (pp. 31-40).

Irving, D. L., Padgett, C. W., Guo, Y., Mintmire, J. W., & Brenner, D. W. (2009). Multiscale modeling of metal-metal contact dynamics under high electromagnetic stress: Timescales and mechanisms for joule melting of Al-Cu asperities. (IEEE Transactions on Magnetics, 45 1) (pp. 331-335).

Purohit, Y., Jang, S., Irving, D. L., Padgett, C. W., Scattergood, R. O., & Brenner, D. W. (2008). Atomistic modeling of the segregation of lead impurities to a grain boundary in an aluminum bicrystalline solid. (Materials Science & Engineering. A, Structural Materials: Properties, Microstructure and Processing, 493 1-2) (pp. 97-100).

Jang, S., Purohit, Y., Irving, D., Padgett, C., Brenner, D., & Scattergood, R. O. (2008). Molecular dynamics simulations of deformation in nanocrystalline Al-Pb alloys. (Materials Science & Engineering. A, Structural Materials: Properties, Microstructure and Processing, 493 1-2) (pp. 53-57).


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