Zobrazeno 1 - 10
of 128
pro vyhledávání: '"Seung-Hoon Jhi"'
Publikováno v:
Physical Review B. 107
Publikováno v:
Physical Review Letters. 130
Using {\it ab initio} approaches for extended Hubbard interactions coupled to phonons, we reveal that the intersite Coulomb interaction plays important roles in determining various distinctive phases of the paradigmatic charge ordered materials of Ba
Autor:
Young-Jae Choi, Seung-Hoon Jhi
Publikováno v:
Physical Review B. 106
The phonon angular momentum (PAM) may exhibit exotic temperature dependence as it is sensitive to the phonon lifetime. Constant phonon-lifetime approximation fails to depict such behavior. Here, we study the PAM of AlN, GaN, and graphene-like boron n
Autor:
Yeonsang Lee, Jeehong Kim, Wooseup Hwang, Golam Haider, In-Chul Hwang, Juho Kim, Moon-Ho Jo, Ji Young Park, Sanghoon Lee, Samik Jhulki, Youngsin Park, Mu-Hyun Baik, Jiyong Park, Young Hwa Jung, Jin Young Koo, Yang-Fang Chen, Kimoon Kim, Barun Dhara, Ajaz Ahmed Dar, Chan-Cuk Hwang, Seung-Hoon Jhi, Monika Kataria, Kangkyun Baek
Publikováno v:
Chem. 6:2035-2045
Summary Poor solubility of π-conjugated two-dimensional polymers (C2Ps) has been a significant roadblock in incorporating these emergent materials into electronic devices by simple solution processing. Here, we report a rational design of triphenyle
We study the lattice dynamics of antiferromagnetic transition-metal oxides by using self-consistent Hubbard functionals. We calculate the ground states of the oxides with the on-site and intersite Hubbard interactions determined self-consistently wit
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https://explore.openaire.eu/search/publication?articleId=doi_dedup___::67c3000d3ec891a2aa3514fe0c7db048
Publikováno v:
Physical Review B. 104
We study the lattice dynamics of group IV semiconductors using the fully ab initio extended Hubbard functional. The on-site and intersite Hubbard interactions are determined self-consistently with recently developed pseudohybrid functionals and inclu
Publikováno v:
Physical Review Materials. 5
Polar metal is a material that hosts both polar distortion and metallicity. Such a material is expected to show exotic magneto-electric phenomena if it superconducts. Here, we theoretically explore ferroelectric and superconducting properties in a se
Autor:
Youngjae Choi, Seung-Hoon Jhi
Publikováno v:
The journal of physical chemistry. B. 124(39)
Machine learning potentials provide an efficient and comprehensive tool to simulate large-scale systems inaccessible by conventional first-principles methods still in a similar level of accuracy. One critical issue in constructing machine learning po
Autor:
Young-Sun Song, Seung-Hoon Jhi
Publikováno v:
Journal of physics. Condensed matter : an Institute of Physics journal. 32(17)
Ge-Sb-Te-based phase-change materials (PCMs) exhibit contrasting electrical and optical properties upon change in atomic structures, which contain the octahedral p -orbital bonding and also substantial disordered vacancies. While extensive studies ha
Autor:
Seung-Hoon Jhi, Myung-Soo Lim
Publikováno v:
Current Applied Physics. 18:541-545
Understanding the role of partially occupied sites in Li-based superionic conductors is key to improving performance of solid-state electrolyte materials. We study the optimized structure of crystalline β-Li3PS4 and the Li-ion diffusion using first-