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Main Authors: Lee, Hyun-Jae, Go, Kyoung-June, Kumar, Pawan, Kim, Chang Hoon, Kim, Yungyeom, Lee, Kyoungjun, Shimizu, Takao, Chae, Seung Chul, Jin, Hosub, Lee, Minseong, Waghmare, Umesh, Choi, Si-Young, Lee, Jun Hee
Format: Preprint
Published: 2024
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Online Access:https://arxiv.org/abs/2403.01415
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author Lee, Hyun-Jae
Go, Kyoung-June
Kumar, Pawan
Kim, Chang Hoon
Kim, Yungyeom
Lee, Kyoungjun
Shimizu, Takao
Chae, Seung Chul
Jin, Hosub
Lee, Minseong
Waghmare, Umesh
Choi, Si-Young
Lee, Jun Hee
author_facet Lee, Hyun-Jae
Go, Kyoung-June
Kumar, Pawan
Kim, Chang Hoon
Kim, Yungyeom
Lee, Kyoungjun
Shimizu, Takao
Chae, Seung Chul
Jin, Hosub
Lee, Minseong
Waghmare, Umesh
Choi, Si-Young
Lee, Jun Hee
contents Ferroelectric domain walls, recognized as distinct from the bulk in terms of symmetry, structure, and electronic properties, host exotic phenomena including conductive walls, ferroelectric vortices, novel topologies, and negative capacitance. Contrary to conventional understanding, our study reveals that the structure of domain walls in HfO2 closely resembles its bulk. First, our first-principles simulations unveil that the robust ferroelectricity is supported by bosonic pairing of all the anionic phonons in bulk HfO2. Strikingly, the paired phonons strongly bond with each other and successfully reach the center of the domain wall without losing their integrity and produce bulk-like domain walls. We then confirmed preservation of the bulk phonon displacements and consequently full revival of the bulk structure at domain walls via aberration-corrected STEM. The newly found duality between the bulk and the domain wall sheds light on previously enigmatic properties such as zero-energy domain walls, perfect Ising-type polar ordering, and exceptionally robust ferroelectricity at the sub-nm scales. The phonon-pairing discovered here is robust against physical boundaries such as domain walls and enables zero momentum and zero-energy cost local ferroelectric switching. This phenomenon demonstrated in Si-compatible ferroelectrics provides a novel technological platform where data storage on domain walls is as feasible as that within the domains, thereby expanding the potential for high-density data storage and advanced ferroelectric applications.
format Preprint
id arxiv_https___arxiv_org_abs_2403_01415
institution arXiv
publishDate 2024
record_format arxiv
spellingShingle Phonon-pair-driven Ferroelectricity Causes Costless Domain-walls and Bulk-boundary Duality
Lee, Hyun-Jae
Go, Kyoung-June
Kumar, Pawan
Kim, Chang Hoon
Kim, Yungyeom
Lee, Kyoungjun
Shimizu, Takao
Chae, Seung Chul
Jin, Hosub
Lee, Minseong
Waghmare, Umesh
Choi, Si-Young
Lee, Jun Hee
Materials Science
Ferroelectric domain walls, recognized as distinct from the bulk in terms of symmetry, structure, and electronic properties, host exotic phenomena including conductive walls, ferroelectric vortices, novel topologies, and negative capacitance. Contrary to conventional understanding, our study reveals that the structure of domain walls in HfO2 closely resembles its bulk. First, our first-principles simulations unveil that the robust ferroelectricity is supported by bosonic pairing of all the anionic phonons in bulk HfO2. Strikingly, the paired phonons strongly bond with each other and successfully reach the center of the domain wall without losing their integrity and produce bulk-like domain walls. We then confirmed preservation of the bulk phonon displacements and consequently full revival of the bulk structure at domain walls via aberration-corrected STEM. The newly found duality between the bulk and the domain wall sheds light on previously enigmatic properties such as zero-energy domain walls, perfect Ising-type polar ordering, and exceptionally robust ferroelectricity at the sub-nm scales. The phonon-pairing discovered here is robust against physical boundaries such as domain walls and enables zero momentum and zero-energy cost local ferroelectric switching. This phenomenon demonstrated in Si-compatible ferroelectrics provides a novel technological platform where data storage on domain walls is as feasible as that within the domains, thereby expanding the potential for high-density data storage and advanced ferroelectric applications.
title Phonon-pair-driven Ferroelectricity Causes Costless Domain-walls and Bulk-boundary Duality
topic Materials Science
url https://arxiv.org/abs/2403.01415