Works (22)

Updated: July 5th, 2023 15:38

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.

By: J. Baker* & D. Irving n

TL;DR: This work presents a novel approach for inverse materials design as it relates to point defect engineering: a particle swarm optimizer to aid in the design of doping profiles, particularly when working with multiple dopants and compound or wide band gap materials. (via Semantic Scholar)
UN Sustainable Development Goal Categories
Source: Web Of Science
Added: January 18, 2022

2021 journal article

Computational approaches to point defect simulations for semiconductor solid solution alloys

JOURNAL OF CHEMICAL PHYSICS, 154(9).

By: K. Mirrielees n, J. Baker n, P. Bowes n & D. Irving n

TL;DR: The approach presented here is expected to be generally appropriate for first approximation of defect properties in semiconductors and dielectrics where the alloy is a random solid solution of the end members. (via Semantic Scholar)
Sources: Web Of Science, ORCID, NC State University Libraries
Added: March 2, 2021

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.

By: P. Bowes n, G. Ryu n, J. Baker n, E. Dickey n & D. Irving

Contributors: P. Bowes n, G. Ryu n, J. Baker n, E. Dickey n & D. Irving

author keywords: barium titanate; defects; density functional theory; dopants; doping; electrical properties
UN Sustainable Development Goal Categories
Sources: Web Of Science, ORCID, NC State University Libraries
Added: June 4, 2021

2021 journal article

Modeling the spatial control over point defect spin states via processing variables

JOURNAL OF APPLIED PHYSICS, 129(22).

By: P. Bowes n, Y. Wu n, J. Baker n & D. Irving n

UN Sustainable Development Goal Categories
Sources: Web Of Science, ORCID, NC State University Libraries
Added: June 16, 2021

2021 journal article

Native oxide reconstructions on AlN and GaN (0001) surfaces

JOURNAL OF APPLIED PHYSICS, 129(19).

By: K. Mirrielees n, J. Dycus n, J. Baker n, P. Reddy*, R. Collazo n, Z. Sitar n, J. LeBeau*, D. Irving n

Sources: Web Of Science, NC State University Libraries
Added: September 13, 2021

2021 journal article

Photochromism of UV-annealed Fe-doped SrTiO3

APPLIED PHYSICS LETTERS, 119(26).

By: Y. Wu n, P. Bowes n, J. Baker n & D. Irving n

UN Sustainable Development Goal Categories
Sources: Web Of Science, ORCID, NC State University Libraries
Added: December 28, 2021

2021 journal article

Self-compensation in heavily Ge doped AlGaN: A comparison to Si doping

APPLIED PHYSICS LETTERS, 118(4).

By: S. Washiyama n, K. Mirrielees n, P. Bagheri n, J. Baker n, J. Kim n, Q. Guo n, R. Kirste*, Y. Guan n ...

Sources: Web Of Science, NC State University Libraries
Added: March 29, 2021

2020 journal article

Complexes and compensation in degenerately donor doped GaN

APPLIED PHYSICS LETTERS, 117(10).

By: J. Baker n, P. Bowes n, J. Harris n, R. Collazo n, Z. Sitar n & D. Irving n

Sources: Web Of Science, ORCID, NC State University Libraries
Added: October 12, 2020

2020 journal article

Influence of space charge on the conductivity of nanocrystalline SrTiO3

JOURNAL OF APPLIED PHYSICS, 128(1).

By: Y. Wu n, P. Bowes n, J. Baker n & D. Irving n

UN Sustainable Development Goal Categories
Sources: Web Of Science, ORCID, NC State University Libraries
Added: August 10, 2020

2020 journal article

Site preference of Y and Mn in nonstoichiometric BaTiO3 from first principles

PHYSICAL REVIEW MATERIALS, 4(8).

By: P. Bowes n, J. Baker n & D. Irving n

UN Sustainable Development Goal Categories
Sources: Web Of Science, ORCID, NC State University Libraries
Added: September 14, 2020

2020 journal article

Survey of acceptor dopants in SrTiO3: Factors limiting room temperature hole concentration

JOURNAL OF THE AMERICAN CERAMIC SOCIETY, 103(2), 1156–1173.

By: P. Bowes n, J. Baker n & D. Irving n

author keywords: defects; density functional theory; perovskite oxides
UN Sustainable Development Goal Categories
Sources: Web Of Science, ORCID, NC State University Libraries
Added: March 30, 2020

2019 journal article

An informatics software stack for point defect-derived opto-electronic properties: the Asphalt Project

MRS COMMUNICATIONS, 9(3), 839–845.

By: J. Baker n, P. Bowes n, J. Harris n & D. Irving n

TL;DR: An informatics and simulation suite to computationally accelerate materials discovery via high-throughput screening and machine learning methods will enable faster and more fundamental materials research, and reduce the cost and time associated with the materials development cycle. (via Semantic Scholar)
UN Sustainable Development Goal Categories
9. Industry, Innovation and Infrastructure (OpenAlex)
Sources: Web Of Science, ORCID, NC State University Libraries
Added: October 21, 2019

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.

By: J. Baker n, P. Bowes n, J. Harris n & D. Irving n

UN Sustainable Development Goal Categories
Sources: Web Of Science, NC State University Libraries
Added: January 28, 2019

2019 journal article

Space charge control of point defect spin states in AlN

APPLIED PHYSICS LETTERS, 115(5).

By: P. Bowes n, Y. Wu n, J. Baker n, J. Harris n & D. Irving

UN Sustainable Development Goal Categories
Sources: Web Of Science, ORCID, NC State University Libraries
Added: August 26, 2019

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.

By: D. Long n, B. Cai n, J. Baker n, P. Bowes n, T. Bayer*, J. Wang*, R. Wang*, L. Chen* ...

Contributors: D. Long n, B. Cai n, J. Baker n, P. Bowes n, T. Bayer*, J. Wang*, R. Wang*, L. Chen* ...

author keywords: conductivity; defect chemistry; resistance degradation; strontium titanate
UN Sustainable Development Goal Categories
Sources: Web Of Science, ORCID, NC State University Libraries, Crossref
Added: May 20, 2019

2018 journal article

Hydrogen solubility in donor-doped SrTiO3 from first principles

APPLIED PHYSICS LETTERS, 113(13).

By: J. Baker n, P. Bowes n & D. Irving n

UN Sustainable Development Goal Categories
Sources: Web Of Science, ORCID
Added: October 16, 2018

2018 journal article

Influence of impurities on the high temperature conductivity of SrTiO3

APPLIED PHYSICS LETTERS, 112(2).

By: P. Bowes n, J. Baker n, J. Harris n, B. Behrhorst n & D. Irving

Sources: Web Of Science, ORCID
Added: August 6, 2018

2018 journal article

Mechanisms governing metal vacancy formation in BaTiO3 and SrTiO3

JOURNAL OF APPLIED PHYSICS, 124(11).

By: J. Baker n, P. Bowes n, J. Harris n & D. Irving

UN Sustainable Development Goal Categories
Sources: Web Of Science, ORCID
Added: October 16, 2018

2018 journal article

On compensation in Si-doped AlN

APPLIED PHYSICS LETTERS, 112(15).

By: J. Harris n, J. Baker n, B. Gaddy n, I. Bryan n, Z. Bryan n, K. Mirrielees n, P. Reddy*, R. Collazo n, Z. Sitar n, D. Irving n

Sources: Web Of Science, ORCID, NC State University Libraries
Added: August 6, 2018

2018 journal article

Point-Defect Nature of the Ultraviolet Absorption Band in AIN

PHYSICAL REVIEW APPLIED, 9(5).

By: D. Alden n, J. Harris n, Z. Bryan n, J. Baker n, P. Reddy n, S. Mita*, G. Callsen*, A. Hoffmann* ...

Contributors: D. Alden n, J. Harris n, Z. Bryan n, J. Baker n, P. Reddy n, S. Mita*, G. Callsen*, A. Hoffmann* ...

Sources: Web Of Science, ORCID, NC State University Libraries
Added: August 6, 2018

2017 journal article

Defect mechanisms of coloration in Fe-doped SrTiO3 from first principles

Applied Physics Letters, 110(12), 122903.

By: J. Baker n, P. Bowes n, D. Long n, A. Moballegh n, J. Harris n, E. Dickey n, D. Irving n

Contributors: J. Baker n, P. Bowes n, D. Long n, A. Moballegh n, J. Harris n, E. Dickey n, D. Irving n

UN Sustainable Development Goal Categories
Sources: Web Of Science, ORCID, NC State University Libraries, Crossref
Added: August 6, 2018

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.

By: T. Bayer*, J. Wang*, J. Carter*, A. Moballegh n, J. Baker n, D. Irving n, E. Dickey n, L. Chen*, C. Randall*

Contributors: T. Bayer*, J. Wang*, J. Carter*, A. Moballegh n, J. Baker n, D. Irving n, E. Dickey n, L. Chen*, C. Randall*

author keywords: Resistance degradation; Perovskites; Impedance spectroscopy; Conductivity profiles; Combined study of measurement and simulation
Sources: Web Of Science, NC State University Libraries, Crossref, ORCID
Added: August 6, 2018

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