Spin-Peierls Distortion of TiPO<sub>4</sub> Causing a Transition from a Magnetic to a Nonmagnetic Insulating State and Its Effect on the Thermoelectric Properties: Density Functional Theory Analysis-Reference-Cited by-同舟云学术

Spin-Peierls Distortion of TiPO₄ Causing a Transition from a Magnetic to a Nonmagnetic Insulating State and Its Effect on the Thermoelectric Properties: Density Functional Theory Analysis

Published:2022-02-23 Issue:9 Volume:61 Page:3843-3850
ISSN:0020-1669
Container-title:Inorganic Chemistry
language:en
Short-container-title:Inorg. Chem.

Author:

Lee Changhoon¹^ORCID,Koo Hyun-Joo²^ORCID,Park Taesu³,Son Won-Joon⁴^ORCID,Shim Ji Hoon³⁵^ORCID,Whangbo Myung-Hwan²⁶^ORCID

Affiliation:

1. Max Planck POSTECH Center for Complex Phase of Materials, Pohang University of Science and Technology, Pohang 37673, Korea

2. Department of Chemistry and Research Institute for Basic Sciences, Kyung Hee University, Seoul 02447, Republic of Korea

3. Department of Chemistry, Pohang University of Science and Technology, Pohang, 37673, Korea

4. Samsung Advanced Institute of Technology (SAIT), Samsung Electronics, 130 Samsung-ro, Yeongtong-gu, Suwon 16678, Korea

5. Division of Advanced Materials Science, Pohang University of Science and Technology, Pohang, 37673, Korea

6. Department of Chemistry, North Carolina State University, Raleigh, North Carolina 27695-8204, United States

Funder

National Research Foundation of Korea

Publisher

American Chemical Society (ACS)

Subject

Inorganic Chemistry,Physical and Theoretical Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.inorgchem.1c03292

Reference52 articles.

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2. Conceptual aspects of structure-property correlations and electronic instabilities, with applications to low-dimensional transition-metal oxides

3. Analogies between the concepts of molecular chemistry and solid-state physics concerning structural instabilities. Electronic origin of the structural modulations in layered transition metal dichalcogenides

4. Observation of the spin-Peierls transition in linearCu2+(spin-1/2) chains in an inorganic compoundCuGeO3

5. Structural analysis ofCuGeO3: Relation between nuclear structure and magnetic interaction

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