HOME > Profile > MIYAZAKI, Tsuyoshi
- MANA Principal Investigator, International Center for Materials Nanoarchitectonics
- Group Leader, Nano-Theory Field, First-Principles Simulation Group, International Center for Materials Nanoarchitectonics
- Fileld Coordinator, Nano-Theory Field, International Center for Materials Nanoarchitectonics
- Center for GaN Characterization and Analysis, Scanning Probe Microscopy Group, RNFS
- Address
- 305-0044 1-1 Namiki Tsukuba Ibaraki JAPAN [Access]
- Profile
- Tag cloud
- Connection
Research
- Keywords
第一原理計算、オーダーN法、プログラム開発
PublicationsNIMS affiliated publications since 2004.
Research papers
- Jack S Baker, Tsuyoshi Miyazaki, David R Bowler. The pseudoatomic orbital basis: electronic accuracy and soft-mode distortions in ABO3 perovskites. Electronic Structure. 2 [2] (2020) 025002 10.1088/2516-1075/ab950e
- Teruo Hirakawa, David R. Bowler, Tsuyoshi Miyazaki, Yoshitada Morikawa, Lionel A. Truflandier. Blue moon ensemble simulation of aquation free energy profiles applied to mono and bifunctional platinum anticancer drugs. Journal of Computational Chemistry. 41 [22] (2020) 1973-1984 10.1002/jcc.26367
- Ayako Nakata, Jack S. Baker, Shereif Y. Mujahed, Jack T. L. Poulton, Sergiu Arapan, Jianbo Lin, Zamaan Raza, Sushma Yadav, Lionel Truflandier, Tsuyoshi Miyazaki, David R. Bowler. Large scale and linear scaling DFT with the CONQUEST code. The Journal of Chemical Physics. 152 [16] (2020) 164112 10.1063/5.0005074
Books
- MIYAZAKI, Tsuyoshi. III.1.3 電子論に基づく構造予測と設計技術. 環境・エネルギー材料ハンドブック. 2011 , 644-654
- MIYAZAKI, Tsuyoshi, R. Choudhury, BOWLER, David, GILLAN, Michael John. Large-scale ab initio caluculations. Computational Modelling and Simulation of Materials III-Part A. 2005 , 3-12
- MIYAZAKI, Tsuyoshi. II.2.2 オーダーNを目指して. 「密度汎関数法の発展 ーマテリアルデザインへの応用ー」（赤井久純・白井光雲編著 シュプリンガー）. 2011 , 141-162
Proceedings
- MIYAZAKI, Tsuyoshi, OHNO, Takahisa. First-principles study of pressure effects on molecular solids (CH3)4N[M(dmit)2]2 (M = Ni, Pd). Proceedings of the 4th Asian Workshop on First-principles Electronic Structure Calculations. , -
- MIYAZAKI, Tsuyoshi, OHNO, Takahisa. Ab initio study of pressure effects on molecular solids (CH3)4N[M(dmit)2]2 (M = Ni, Pd). Molecular Crystals and Liquid Crystals. , -
- Michael J. Gillan, David R. Bowler, Antonio S. Torralba, MIYAZAKI, Tsuyoshi. Order-N first-principles calculations with the CONQUEST code . COMPUTER PHYSICS COMMUNICATIONS. 2007, 14-18
Presentations
- MIYAZAKI, Tsuyoshi. ET系の圧力下の構造と電子状態に対する第一原理計算とそれに基づくTBモデルの構築. 埼玉大学理学部物理学科物性セミナー. 2006
- TSUMURAYA, Takao, Hitoshi Seo, Reizo Kato, MIYAZAKI, Tsuyoshi. Structural and electronic properties of charge ordered state in molecular conductors with hydrogen bonds. 18th Asian Workshop on First-Principles Calculations. 2015
- MIYAZAKI, Tsuyoshi, KINO, Hiori. beta'-(BEDT-TTF)2AuCl2の圧力下の構造と電子状態. 日本物理学会 2004年秋季大会. 2004
Coming soon!
Coming soon!