2022 article
Inverse Materials Design of Doping Strategies with AI, Thermodynamics, and Density Functional Theory
Baker, J. N., & Irving, D. L. (2022, January 7). JOM.
2021 journal article
Computational approaches to point defect simulations for semiconductor solid solution alloys
JOURNAL OF CHEMICAL PHYSICS, 154(9).
2021 article
Fermi level pinning in Co-doped BaTiO3: Part II. Defect chemistry models
Bowes, P. C., Ryu, G. H., Baker, J. N., Dickey, E. C., & Irving, D. L. (2021, July 29). JOURNAL OF THE AMERICAN CERAMIC SOCIETY, Vol. 7.
2021 journal article
Modeling the spatial control over point defect spin states via processing variables
JOURNAL OF APPLIED PHYSICS, 129(22).
2021 journal article
Native oxide reconstructions on AlN and GaN (0001) surfaces
JOURNAL OF APPLIED PHYSICS, 129(19).
Contributors: K. Mirrielees n, J. Dycus n, n, P. Reddy* , R. Collazo n , Z. Sitar n, J. Lebeau*, D. Irving n
2021 journal article
Photochromism of UV-annealed Fe-doped SrTiO3
APPLIED PHYSICS LETTERS, 119(26).
2021 journal article
Self-compensation in heavily Ge doped AlGaN: A comparison to Si doping
APPLIED PHYSICS LETTERS, 118(4).
Contributors: S. Washiyama n, K. Mirrielees n, P. Bagheri n, n, J. Kim n, Q. Guo n, R. Kirste*, Y. Guan n
2020 journal article
Complexes and compensation in degenerately donor doped GaN
APPLIED PHYSICS LETTERS, 117(10).
2020 journal article
Influence of space charge on the conductivity of nanocrystalline SrTiO3
JOURNAL OF APPLIED PHYSICS, 128(1).
2020 journal article
Site preference of Y and Mn in nonstoichiometric BaTiO3 from first principles
PHYSICAL REVIEW MATERIALS, 4(8).
2019 journal article
An informatics software stack for point defect-derived opto-electronic properties: the Asphalt Project
MRS COMMUNICATIONS, 9(3), 839–845.
2019 article
Mechanisms governing metal vacancy formation in BaTiO3 and SrTiO3 (vol 124, 114101, 2018)
Baker, J. N., Bowes, P. C., Harris, J. S., & Irving, D. L. (2019, January 7). JOURNAL OF APPLIED PHYSICS, Vol. 125.
2019 journal article
Space charge control of point defect spin states in AlN
APPLIED PHYSICS LETTERS, 115(5).
2019 journal article
Survey of acceptor dopants in SrTiO3: Factors limiting room temperature hole concentration
JOURNAL OF THE AMERICAN CERAMIC SOCIETY, 103(2), 1156–1173.
2018 journal article
Conductivity of iron‐doped strontium titanate in the quenched and degraded states
Journal of the American Ceramic Society, 102(6), 3567–3577.
2018 journal article
Hydrogen solubility in donor-doped SrTiO3 from first principles
APPLIED PHYSICS LETTERS, 113(13).
2018 journal article
Influence of impurities on the high temperature conductivity of SrTiO3
APPLIED PHYSICS LETTERS, 112(2).
2018 journal article
Mechanisms governing metal vacancy formation in BaTiO3 and SrTiO3
JOURNAL OF APPLIED PHYSICS, 124(11).
2018 journal article
On compensation in Si-doped AlN
APPLIED PHYSICS LETTERS, 112(15).
Contributors: J. Harris n, n, B. Gaddy n, I. Bryan n, Z. Bryan n, K. Mirrielees n, P. Reddy* , R. Collazo n , Z. Sitar n, D. Irving n
2018 journal article
Point-Defect Nature of the Ultraviolet Absorption Band in AIN
PHYSICAL REVIEW APPLIED, 9(5).
Contributors: D. Alden n, J. Harris n, Z. Bryan n, n, P. Reddy n , S. Mita *, G. Callsen *, A. Hoffmann *
2017 journal article
Defect mechanisms of coloration in Fe-doped SrTiO3 from first principles
Applied Physics Letters, 110(12), 122903.
2016 journal article
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.
Contributors: T. Bayer *, J. Wang *, J. Carter*, A. Moballegh n, n, D. Irving n, E. Dickey n , L. Chen *, C. Randall *
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