H. Takenaka

activity

20072021

most citedPost density functional theoretical studies of highly polar semiconductive Pb(Ti

_{1 - x}

_{x}

_{3 - x}

solid solutions: The effects of cation arrangement on band gap

158 citations · 422 across the 10 of their papers we have counts for

collaborators

Showing 2012Show all

2 papers · 1 filter

cond-mat.mtrl-sci2012★ 87 cited

Anisotropic Local Correlations and Dynamics in a Relaxor Ferroelectric

Hiroyuki Takenaka, Ilya Grinberg, Andrew M. Rappe

Relaxor ferroelectrics have been a focus of intense attention due to their anomalous dielectric characteristics, diffuse phase transitions, and strong piezoelectricity. Understandi…

cond-mat.mtrl-sci2012★ 63 cited

Reinterpretation of bond-valence model with bond-order formalism: an improved bond-valence based interatomic potential for PbTiO $_{3}$

Shi Liu, Ilya Grinberg, Hiroyuki Takenaka +1

We present a modified bond-valence model of PbTiO $_{3}$ based on the principles of bond-valence and bond-valence vector conservation. The relationship between the bond-valence model…

Anisotropic Local Correlations and Dynamics in a Relaxor Ferroelectric

Reinterpretation of bond-valence model with bond-order formalism: an improved bond-valence based interatomic potential for PbTiO3​

Reinterpretation of bond-valence model with bond-order formalism: an improved bond-valence based interatomic potential for PbTiO $_{3}$