Miyata Tatsuhiko 宮田竜彦

… Alternative Names

MIYATA Tatsuhiko 宮田竜彦

Less

Researcher Number	70390648
Other IDs
Affiliation (Current)	2025: 愛媛大学, 理工学研究科(理学系), 准教授
Affiliation (based on the past Project Information) *help	2016 – 2023: 愛媛大学, 理工学研究科(理学系), 講師
Review Section/Research Field	Principal Investigator Basic Section 32010:Fundamental physical chemistry-related / Physical chemistry
Keywords	Principal Investigator 熱力学 / 統計力学 / Ornstein-Zernike理論 / 溶融塩 / Lennard-Jones流体 / 溶媒和自由エネルギー / 変分原理 / 積分方程式理論 / 間接相関関数 / ブリッジ関数 … More / 分子シミュレーション / 液体論 / 化学物理 / LJ流体 / 動径分布関数 / 熱力学量 / MOZ理論 / 3D-RISM理論 / 2D-OZ理論 / LJポテンシャル / 平均力ポテンシャル / 3D-OZ理論 / クーロンポテンシャル / 溶媒-溶媒相関関数 / MD hybrid closure / クーロン系 / hybrid closure / closure近似 / 分子動力学シミュレーション / RISM理論 / OZ理論 Less

Development of an integral equation theory satisfying the variational principle and accurate for long-range potential systemsPrincipal Investigator
- Principal Investigator
  
  宮田竜彦
- Project Period (FY)
  2023 – 2026
- Research Category
  
  Grant-in-Aid for Scientific Research (C)
- Review Section
  
  Basic Section 32010:Fundamental physical chemistry-related
- Research Institution
  Ehime University
A study on the OZ theory to improve the accuracy of thermodynamic quantitiesPrincipal Investigator
- Principal Investigator
  
  MIYATA Tatsuhiko
- Project Period (FY)
  2016 – 2023
- Research Category
  
  Grant-in-Aid for Scientific Research (C)
- Research Field
  
  Physical chemistry
- Research Institution
  Ehime University

All 2023 2022 2021 2020 2019 2018 2017 2016

All Journal Article Presentation Book

[Book] 材料表面の親水・親油の評価と制御設計　第8章　第10節2016
- Author(s)
  宮田竜彦・吉田紀生
- Total Pages
  4
- Publisher
  テクノシステム
- Data Source
  KAKENHI-PROJECT-16K05659
[Journal Article] A study on the approximated angular averaging of distribution functions obtained from the Ornstein?Zernike theory for diatomic solutes consisting of fused Lennard-Jones particles immersed in a Lennard?Jones monatomic solvent2023
- Author(s)
  Miyata Tatsuhiko、Fukuma Kazuki、Kiuchi Tatsuhiro
- Journal Title
  
  Journal of Molecular Liquids
  
  Volume: 388 Pages: 122803-122803
- DOI
  10.1016/j.molliq.2023.122803
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-16K05659
[Journal Article] A study on the extension of correlation functions obtained from molecular dynamics simulations by the Ornstein?Zernike theory for modeled molten salts2023
- Author(s)
  Miyata Tatsuhiko、Funahara Yu、Omori Seiya、Shinjo Taro
- Journal Title
  
  AIP Advances
  
  Volume: 13 Issue: 11 Pages: 115322-115322
- DOI
  10.1063/5.0180366
- Peer Reviewed / Open Access
- Data Source
  KAKENHI-PROJECT-23K04666, KAKENHI-PROJECT-16K05659
[Journal Article] Sigma enlarging bridge correction of three dimensional Ornstein?Zernike theory for solvation free energy of polyatomic solutes immersed in Lennard-Jones monatomic solvent2022
- Author(s)
  Miyata Tatsuhiko、Hikasa Yusuke
- Journal Title
  
  AIP Advances
  
  Volume: 12 Issue: 8 Pages: 085206-085206
- DOI
  10.1063/5.0102003
- Peer Reviewed / Open Access
- Data Source
  KAKENHI-PROJECT-16K05659
[Journal Article] Integral equation study of effective attraction between like-charged particles mediated by cations: Comparison between IPY2 and HNC closures2022
- Author(s)
  Takeda M.、Maruyama K.、Akiyama R.、Miyata T.
- Journal Title
  
  Europhysics Letters
  
  Volume: 140 Issue: 1 Pages: 17001-17001
- DOI
  10.1209/0295-5075/ac94f5
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-16K05659, KAKENHI-PROJECT-21K18604, KAKENHI-PROJECT-19H01863
[Journal Article] Accuracy of some useful closure relations in combination with the reference interaction site model theory for fluids of single component diatomic molecules2022
- Author(s)
  Miyata Tatsuhiko、Murata Shohei、Sakamoto Megumi、Sasaki Yasushi
- Journal Title
  
  AIP Advances
  
  Volume: 12 Issue: 3 Pages: 035248-035248
- DOI
  10.1063/5.0085014
- Peer Reviewed / Open Access
- Data Source
  KAKENHI-PROJECT-16K05659
[Journal Article] Extending correlation functions of molecular dynamics simulation by Kovalenko?Hirata and Kobryn?Gusarov?Kovalenko closures for monatomic Lennard-Jones solvent and its application to a calculation of solvation2021
- Author(s)
  Miyata Tatsuhiko、Nishida Shunsuke、Ogasawara Yu
- Journal Title
  
  AIP Advances
  
  Volume: 11 Issue: 2 Pages: 025026-025026
- DOI
  10.1063/5.0043388
- Peer Reviewed / Open Access
- Data Source
  KAKENHI-PROJECT-16K05659
[Journal Article] Transferability of Sigma Enlarging Bridge Function for Lennard-Jones Diatomic Solute Using Monatomic Solvent Correlation Obtained from Molecular Dynamics Simulation2020
- Author(s)
  Miyata Tatsuhiko、Yabuki Naoya、Leung Jackie
- Journal Title
  
  Chemistry Letters
  
  Volume: 49 Issue: 11 Pages: 1372-1375
- DOI
  10.1246/cl.200521
- NAID
  130007936948
- Peer Reviewed / Open Access
- Data Source
  KAKENHI-PROJECT-16K05659
[Journal Article] Sigma enlarging bridge function for heteronuclear Lennard-Jones diatomic solute solvated in a Lennard-Jones monatomic solvent in terms of the parameter transferability2020
- Author(s)
  Miyata Tatsuhiko
- Journal Title
  
  Chemical Physics Letters
  
  Volume: 755 Pages: 137777-137777
- DOI
  10.1016/j.cplett.2020.137777
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-16K05659
[Journal Article] A study on the transferability of the sigma enlarging bridge function for an accurate evaluation of solvation free energy: The case of homonuclear Lennard-Jones diatomic solute solvated in a Lennard-Jones monatomic solvent2019
- Author(s)
  Miyata Tatsuhiko、Yabuki Naoya
- Journal Title
  
  AIP Advances
  
  Volume: 9 Issue: 2 Pages: 025310-025310
- DOI
  10.1063/1.5087935
- Peer Reviewed / Open Access
- Data Source
  KAKENHI-PROJECT-16K05659
[Journal Article] An assessment of the sigma enlarging bridge function for a Lennard-Jones solution using a solvent-solvent correlation function obtained from molecular dynamics simulation2019
- Author(s)
  Miyata Tatsuhiko、Ogasawara Yu、Fujii Takahiro、Yano Daigo、Ebato Yuki
- Journal Title
  
  Journal of Molecular Liquids
  
  Volume: 290 Pages: 111167-111167
- DOI
  10.1016/j.molliq.2019.111167
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-16K05659
[Journal Article] Molecular Dynamics Simulations of Theoretical Cellulose Nanotube Models2018
- Author(s)
  Takuya Uto, Yuta Kodama, Tatsuhiko Miyata, Toshifumi Yui
- Journal Title
  
  Carbohydrate Polymers
  
  Volume: 190 Pages: 331-338
- DOI
  10.1016/j.carbpol.2018.03.004
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-16J10411, KAKENHI-PROJECT-16K05659
[Journal Article] Performance of Kobryn-Gusarov-Kovalenko closure from a thermodynamic viewpoint for one-component Lennard-Jones fluids2018
- Author(s)
  Miyata Tatsuhiko、Tange Kentaro
- Journal Title
  
  Chemical Physics Letters
  
  Volume: 700 Pages: 88-95
- DOI
  10.1016/j.cplett.2018.04.013
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-16K05659
[Journal Article] A Parameterization of Empirical Sigma Enlarging Bridge Correction of Kovalenko-Hirata Closure in Ornstein-Zernike Theory for Lennard-Jones Fluids2017
- Author(s)
  Tatsuhiko Miyata
- Journal Title
  
  Bull. Chem. Soc. Jpn.
  
  Volume: 90 Issue: 10 Pages: 1095-1104
- DOI
  10.1246/bcsj.20170203
- NAID
  130006770689
- Peer Reviewed / Open Access
- Data Source
  KAKENHI-PROJECT-16K05659
[Journal Article] Correction of Kovalenko-Hirata closure in Ornstein-Zernike integral equation theory for Lennard-Jones fluids2017
- Author(s)
  Tatsuhiko Miyata and Yuki Ebato
- Journal Title
  
  J. Molec. Liquids
  
  Volume: 245 Pages: 2-10
- DOI
  10.1016/j.molliq.2017.05.134
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-16K05659
[Journal Article] Thermodynamic significance to correct the location of first rising region in radial distribution function approximately estimated from Ornstein-Zernike integral equation theory for Lennard-Jones fluids2016
- Author(s)
  Tatsuhiko Miyata and Yuki Ebato
- Journal Title
  
  J. Molec. Liquids
  
  Volume: 217 Pages: 75-82
- DOI
  10.1016/j.molliq.2015.11.054
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-16K05659
[Journal Article] Accuracy of Temperature-Derivative of Radial Distribution Function Calculated under Approximations in Ornstein-Zernike Theory for One-Component Lennard-Jones Fluid2016
- Author(s)
  Tatsuhiko Miyata and Sanae Miyazaki
- Journal Title
  
  Chem. Phys. Lett.
  
  Volume: 658 Pages: 224-229
- DOI
  10.1016/j.cplett.2016.06.049
- Peer Reviewed / Acknowledgement Compliant
- Data Source
  KAKENHI-PROJECT-16K05659
[Journal Article] A pressure consistent bridge correction of Kovalenko-Hirata closure in Ornstein-Zernike theory for Lennard-Jones fluids by apparently adjusting sigma parameter2016
- Author(s)
  Yuki Ebato and Tatsuhiko Miyata
- Journal Title
  
  AIP advances
  
  Volume: 6 Issue: 5 Pages: 055111-055111
- DOI
  10.1063/1.4950703
- Peer Reviewed / Acknowledgement Compliant / Open Access
- Data Source
  KAKENHI-PROJECT-16K05659
[Presentation] OZ理論を利用して分子動力学法の動径分布関数を延伸する方法の検討：溶融塩モデルの場合2023
- Author(s)
  宮田竜彦・舩原優・大森晟矢・新城太郎
- Organizer
  第45回溶液化学シンポジウム
- Data Source
  KAKENHI-PROJECT-23K04666
[Presentation] OZ理論を利用して分子動力学法の動径分布関数を延伸する方法の検討：溶融塩モデルの場合2023
- Author(s)
  宮田竜彦・舩原優・大森晟矢・新城太郎
- Organizer
  第45回溶液化学シンポジウム
- Data Source
  KAKENHI-PROJECT-16K05659
[Presentation] Application of the sigma enlarging bridge correction to polyatomic solutes solvated in Lennard-Jones monatomic solvent2022
- Author(s)
  Tatsuhiko Miyata and Yusuke Hikasa
- Organizer
  The 15th Mini-Symposium on Liquids (MSL2022)
- Data Source
  KAKENHI-PROJECT-16K05659
[Presentation] 多原子溶質周りでの単原子LJ溶媒の分布関数を角度平均するための近似法の提案2022
- Author(s)
  宮田竜彦・木内竜大・福間和輝・高橋侑己
- Organizer
  第44回溶液化学シンポジウム
- Data Source
  KAKENHI-PROJECT-16K05659
[Presentation] Development of concepts and bridge functions to improve the accuracy of solvation free energy for molecular liquids2021
- Author(s)
  Tatsuhiko Miyata
- Organizer
  Pacifichem 2021
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K05659
[Presentation] OZ系の積分方程式理論から求まる溶媒和自由エネルギー高精度化の試み2019
- Author(s)
  宮田竜彦
- Organizer
  研究会「凝縮系の理論化学」
- Invited
- Data Source
  KAKENHI-PROJECT-16K05659
[Presentation] SEB correction to improve the accuracy of solvation free energy for LJ fluids: an attempt to prepare solvent-solvent correlation function by MD simulation2019
- Author(s)
  Tatsuhiko Miyata, Takahiro Fujii, Daigo Yano, Yu Ogasawara and Yuki Ebato
- Organizer
  日本化学会第99春季年会
- Data Source
  KAKENHI-PROJECT-16K05659
[Presentation] Integral equation theory for describing the solvation of heteronuclear LJ diatomic solute in LJ monatomic solvent2019
- Author(s)
  Tatsuhiko Miyata and Tatsuhiro Kiuchi
- Organizer
  The 13th Mini-Symposium on Liquids (MSL2019)
- Data Source
  KAKENHI-PROJECT-16K05659
[Presentation] RISM理論における二原子分子流体の熱力学量の精度に関する研究2019
- Author(s)
  宮田竜彦・坂本萌・佐々木康
- Organizer
  第42回溶液化学シンポジウム
- Data Source
  KAKENHI-PROJECT-16K05659
[Presentation] Accuracy of solvation free energy evaluated from Ornstein-Zernike integral equation theory2018
- Author(s)
  Tatsuhiko Miyata and Naoya Yabuki
- Organizer
  日本化学会第98春季年会
- Data Source
  KAKENHI-PROJECT-16K05659
[Presentation] Accuracy of OZ Theory: Solvation Free Energy of LJ Diatomic Solute in LJ Solvent2018
- Author(s)
  Tatsuhiko Miyata and Naoya Yabuki
- Organizer
  The 12th Mini-Symposium on Liquids (MSL2018)
- Data Source
  KAKENHI-PROJECT-16K05659
[Presentation] Sigma enlarging bridge correction for an accurate evaluation of solvation free energy of Lennard-Jones fluids: an attempt to utilize molecular simulation in preparing solvent-solvent correlation function2018
- Author(s)
  Tatsuhiko Miyata, Takahiro Fujii, Daigo Yano, Yu Ogasawara and Yuki Ebato
- Organizer
  EMLG-JMLG Annual Meeting 2018
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K05659
[Presentation] OZ系積分方程式理論を用いた溶媒和の計算：ミセルへの応用へ向けて2017
- Author(s)
  宮田竜彦
- Organizer
  高分子学会九州支部フォーラム
- Place of Presentation
  福岡大学（福岡県福岡市）
- Invited
- Data Source
  KAKENHI-PROJECT-16K05659
[Presentation] OZ理論による溶媒和自由エネルギーの精度：LJ 溶媒へのLJ 等核二原子分子の溶媒和について2017
- Author(s)
  宮田竜彦・矢吹直哉
- Organizer
  第40回溶液化学シンポジウム
- Data Source
  KAKENHI-PROJECT-16K05659
[Presentation] Ornstein-Zernike 理論に基づく溶媒和自由エネルギー高精度化の試み2017
- Author(s)
  宮田竜彦・矢吹直哉
- Organizer
  第31回分子シミュレーション討論会
- Data Source
  KAKENHI-PROJECT-16K05659
[Presentation] OZ理論における近似が溶媒和自由エネルギーに及ぼす影響：LJ溶媒の場合2017
- Author(s)
  宮田竜彦
- Organizer
  スーパーコンピューターワークショップ2017
- Place of Presentation
  分子科学研究所（愛知県岡崎市）
- Year and Date
  2017-02-01
- Data Source
  KAKENHI-PROJECT-16K05659
[Presentation] Ornstein-Zernike型積分方程式理論に基づく溶媒和自由エネルギーの高精度化2017
- Author(s)
  宮田竜彦・矢吹直哉
- Organizer
  第66回高分子討論会
- Data Source
  KAKENHI-PROJECT-16K05659
[Presentation] Accuracy of solvation free energy evaluated from Ornstein-Zernike integral equation theory for Lennard-Jones solvent system2017
- Author(s)
  Tatsuhiko Miyata
- Organizer
  International Workshop on Stat-Mech of Liquids
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K05659
[Presentation] OZ理論から求まる溶媒和自由エネルギーの高精度化の試み2016
- Author(s)
  宮田竜彦
- Organizer
  第39回溶液化学シンポジウム
- Place of Presentation
  産業技術総合研究所（茨城県つくば市）
- Year and Date
  2016-11-09
- Data Source
  KAKENHI-PROJECT-16K05659
[Presentation] OZ理論における近似がLJ系の熱力学量に及ぼす影響2016
- Author(s)
  宮田竜彦
- Organizer
  研究会「分子を使った寄せ木細工」～自己組織化したソフトマテリアルが織りなす「かたち」と機能～
- Place of Presentation
  島根大学（島根県松江市）
- Year and Date
  2016-05-27
- Invited
- Data Source
  KAKENHI-PROJECT-16K05659
[Presentation] Correction of Kovalenko-Hirata closure in Ornstein-Zernike integral equation theory for Lennard-Jones fluids2016
- Author(s)
  Tatsuhiko Miyata and Yuki Ebato
- Organizer
  EMLG-JMLG Annual Meeting 2016
- Place of Presentation
  Chania, Crete, Greece
- Year and Date
  2016-09-11
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K05659

1. 宇都卓也

# of Collaborated Projects: 0 results

# of Collaborated Products: 1 results

Miyata Tatsuhiko 宮田 竜彦

MIYATA Tatsuhiko 宮田 竜彦

Research Projects

Research Products

Co-Researchers

Development of an integral equation theory satisfying the variational principle and accurate for long-range potential systemsPrincipal Investigator

Principal Investigator

Project Period (FY)

Research Category

Review Section

Research Institution

A study on the OZ theory to improve the accuracy of thermodynamic quantitiesPrincipal Investigator

Principal Investigator

Project Period (FY)

Research Category

Research Field

Research Institution

[Book] 材料表面の親水・親油の評価と制御設計 第8章 第10節2016

Author(s)

Total Pages

Publisher

Data Source

[Journal Article] A study on the approximated angular averaging of distribution functions obtained from the Ornstein?Zernike theory for diatomic solutes consisting of fused Lennard-Jones particles immersed in a Lennard?Jones monatomic solvent2023

Author(s)

Journal Title

DOI

Data Source

[Journal Article] A study on the extension of correlation functions obtained from molecular dynamics simulations by the Ornstein?Zernike theory for modeled molten salts2023

Author(s)

Journal Title

DOI

Data Source

[Journal Article] Sigma enlarging bridge correction of three dimensional Ornstein?Zernike theory for solvation free energy of polyatomic solutes immersed in Lennard-Jones monatomic solvent2022

Author(s)

Journal Title

DOI

Data Source

[Journal Article] Integral equation study of effective attraction between like-charged particles mediated by cations: Comparison between IPY2 and HNC closures2022

Author(s)

Journal Title

DOI

Data Source

[Journal Article] Accuracy of some useful closure relations in combination with the reference interaction site model theory for fluids of single component diatomic molecules2022

Author(s)

Journal Title

DOI

Data Source

[Journal Article] Extending correlation functions of molecular dynamics simulation by Kovalenko?Hirata and Kobryn?Gusarov?Kovalenko closures for monatomic Lennard-Jones solvent and its application to a calculation of solvation2021

Author(s)

Journal Title

DOI

Data Source

[Journal Article] Transferability of Sigma Enlarging Bridge Function for Lennard-Jones Diatomic Solute Using Monatomic Solvent Correlation Obtained from Molecular Dynamics Simulation2020

Author(s)

Journal Title

DOI

NAID

Data Source

[Journal Article] Sigma enlarging bridge function for heteronuclear Lennard-Jones diatomic solute solvated in a Lennard-Jones monatomic solvent in terms of the parameter transferability2020

Author(s)

Journal Title

DOI

Data Source

[Journal Article] A study on the transferability of the sigma enlarging bridge function for an accurate evaluation of solvation free energy: The case of homonuclear Lennard-Jones diatomic solute solvated in a Lennard-Jones monatomic solvent2019

Author(s)

Journal Title

DOI

Data Source

[Journal Article] An assessment of the sigma enlarging bridge function for a Lennard-Jones solution using a solvent-solvent correlation function obtained from molecular dynamics simulation2019

Author(s)

Journal Title

DOI

Data Source

[Journal Article] Molecular Dynamics Simulations of Theoretical Cellulose Nanotube Models2018

Author(s)

Journal Title

DOI

Data Source

[Journal Article] Performance of Kobryn-Gusarov-Kovalenko closure from a thermodynamic viewpoint for one-component Lennard-Jones fluids2018

Author(s)

Miyata Tatsuhiko 宮田竜彦

MIYATA Tatsuhiko 宮田竜彦

[Book] 材料表面の親水・親油の評価と制御設計　第8章　第10節2016