Structure, Energetics, and Spectra for the Oxygen Vacancy in Rutile: Prominence of the Ti–HO–Ti Bond-Reference-Cited by-同舟云学术

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Structure, Energetics, and Spectra for the Oxygen Vacancy in Rutile: Prominence of the Ti–HO–Ti Bond

Published:2021-10-13 Issue:41 Volume:12 Page:10175-10181
ISSN:1948-7185
Container-title:The Journal of Physical Chemistry Letters
language:en
Short-container-title:J. Phys. Chem. Lett.

Author:

Palfey William R.¹^ORCID,Rossman George R.¹,Goddard William A.²

Affiliation:

1. Division of Geological and Planetary Sciences, California Institute of Technology, Pasadena, California 91125, United States

2. Materials and Process Simulation Center (MSC), MC 139-74, California Institute of Technology, Pasadena, California 91125, United States

Funder

Liquid Sunlight Alliance, U.S. Department of Energy

National Science Foundation (USA)

Publisher

American Chemical Society (ACS)

Subject

General Materials Science,Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jpclett.1c02850

Reference48 articles.

1. Photocatalysis on TiO2 Surfaces: Principles, Mechanisms, and Selected Results

2. Defect chemistry and semiconducting properties of titanium dioxide: I. Intrinsic electronic equilibrium☆

3. n-Type doping of TiO2 with atomic hydrogen-observation of the production of conduction band electrons by infrared spectroscopy

4. Hydration of Rutile TiO2: Thermodynamics and Effects on n- and p-Type Electronic Conduction

5. An experimental study of OH solubility in rutile at 500-900 C, 0.5-2 GPa, and a range of oxygen fugacities

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1. Machine Learning, Density Functional Theory, and Experiments to Understand the Photocatalytic Reduction of CO₂ on CuPt/TiO₂;The Journal of Physical Chemistry C;2024-08-15

2. Crystal Structure, Vibrational Spectra on Trivalent-Cation-Doped Rutile and Application in Optical Materials;The Journal of Physical Chemistry C;2023-06-19

3. Inserted hydrogen promotes oxidation catalysis of mixed Ru_0.3Ti_0.7O₂ as exemplified with total propane oxidation and the HCl oxidation reaction;Catalysis Science & Technology;2023

4. Low‐Energy Hydrogen Ions Enable Efficient Room‐Temperature and Rapid Plasma Hydrogenation of TiO ₂ Nanorods for Enhanced Photoelectrochemical Activity;Small;2022-10-03

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