Publications
Filters: Author is Van de Walle, Chris G [Clear All Filters]
Impact of Point Defects on Proton Conduction in Strontium Cerate. The Journal of Physical Chemistry C. 120:9562–9568.
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2016. Impact of point defects on electrochromism in WO 3. Oxide-based Materials and Devices IX.
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2018. Impact of native defects in high-k dielectric oxides on GaN/oxide metal–oxide–semiconductor devices. physica status solidi (b). 250:787–791.
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2013. Identification of microscopic hole-trapping mechanisms in nitride semiconductors. IEEE Electron Device Letters. 37:154–156.
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2016. Hydrogen Passivation of Impurities in Al2O3. ACS applied materials & interfaces. 6:4149–4153.
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2014. Hydrogen intercalation in MoS 2. Physical Review B. 94(8):085426.
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2016. Hydrogen bonds in Al2O3 as dissipative two-level systems in superconducting qubits. Scientific reports. 4
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2014. Hybrid functional study of native point defects and impurities in ZnGeN2. Journal of Applied Physics. 122:195701.
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2017. Hole Trapping at Acceptor Impurities and Alloying Elements in AlN. physica status solidi (RRL)–Rapid Research Letters.
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2021. Giant polarization charge density at lattice-matched GaN/ScN interfaces. Applied Physics Letters. 115:232103.
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2019. Fundamental limits on the electron mobility of $\beta$-Ga2O3. Journal of Physics: Condensed Matter. 29:234001.
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2017. First-principles theory of acceptors in nitride semiconductors. physica status solidi (b). 252:900–908.
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2015. First-principles surface energies for monoclinic Ga2O3 and Al2O3 and consequences for cracking of (Al x Ga1- x) 2O3. APL Materials. 8:091105.
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2020. First-principles study of vacancy-assisted impurity diffusion in ZnO. APL Materials. 2:096101.
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2014. First-principles study of transport in WO 3. Physical Review B. 101:045116.
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2020. First-principles study of the mobility of SrTiO 3. Physical Review B. 90:241204.
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2014. First-principles study of high-field-related electronic behavior of group-III nitrides. Physical Review B. 90:121201.
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2014. First-principles study of electron-phonon interactions and transport in anatase TiO 2. Physical Review B. 100:121113.
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2019. First-principles study of electron transport in ScN. arXiv preprint arXiv:2105.07323.
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2021. First-principles study of direct and indirect optical absorption in BaSnO3. Applied Physics Letters. 112:062106.
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2018. First-principles study of antisite defects in perovskite stannates. Journal of Applied Physics. 126:195701.
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2019. First-principles characterization of defects in WO 3. Oxide-based Materials and Devices IX.
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2018. First-principles calculations of optical transitions at native defects and impurities in ZnO. Oxide-based Materials and Devices IX.
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2018. First-principles calculations of indirect Auger recombination in nitride semiconductors. arXiv preprint arXiv:1412.7555.
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2014. First-principles calculations of hyperfine interaction, binding energy, and quadrupole coupling for shallow donors in silicon. npj Computational Materials. 6:1–9.
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2020.