Haruyama Jun 春山潤

Researcher Number	80772003
Other IDs
Affiliation (Current)	2025: 国立研究開発法人理化学研究所, 開拓研究所, 研究員
Affiliation (based on the past Project Information) *help	2024 – 2025: 国立研究開発法人理化学研究所, 開拓研究本部, 研究員 2018 – 2023: 東京大学, 物性研究所, 助教 2017: 国立研究開発法人産業技術総合研究所, 材料・化学領域, 産総研特別研究員 2016: 国立研究開発法人物質・材料研究機構, ナノ材料科学環境拠点, NIMSポスドク研究員
Review Section/Research Field	Principal Investigator Transformative Research Areas, Section (II) / Basic Section 29020:Thin film/surface and interfacial physical properties-related / Basic Section 36020:Energy-related chemistry / Inorganic industrial materials
Keywords	Principal Investigator 第一原理計算 / リチウムイオン電池 / 電極/電解液界面 / 電荷移動反応 / Liイオン電池 / 非線形感受率 / 表面吸着水 / 溶液理論 / 電気化学反応シミュレーション / 非線形分光 … More / 燃料電池 / 金属/水界面 / 電気化学 / 固体電解質 / 固固界面 / 固々界面 / 界面イオン拡散 / 界面抵抗 / グラファイト / 全固体電池 / 電極/電解質界面 Less

第一原理機械学習力場と分子動力学法を用いた超イオン伝導体の拡散・相転移挙動の研究Principal Investigator
- Principal Investigator
  
  春山潤
- Project Period (FY)
  2025 – 2026
- Research Category
  
  Grant-in-Aid for Transformative Research Areas (A)
- Review Section
  
  Transformative Research Areas, Section (II)
- Research Institution
  Institute of Physical and Chemical Research
First-principles study of water adsorption layer on metal surfacePrincipal Investigator
- Principal Investigator
  
  春山潤
- Project Period (FY)
  2024 – 2027
- Research Category
  
  Grant-in-Aid for Scientific Research (C)
- Review Section
  
  Basic Section 29020:Thin film/surface and interfacial physical properties-related
- Research Institution
  Institute of Physical and Chemical Research
The study for charge transfer reaction in Li-ion battery using first-principles calculation combined with implicit salvation modelPrincipal Investigator
- Principal Investigator
  
  Haruyama Jun
- Project Period (FY)
  2020 – 2023
- Research Category
  
  Grant-in-Aid for Early-Career Scientists
- Review Section
  
  Basic Section 36020:Energy-related chemistry
- Research Institution
  The University of Tokyo
First-Principles Study of Cathode/Electrolyte Interfaces for All-Solid-State Li-Ion BatteryPrincipal Investigator
- Principal Investigator
  
  Haruyama Jun
- Project Period (FY)
  2016 – 2019
- Research Category
  
  Grant-in-Aid for Young Scientists (B)
- Research Field
  
  Inorganic industrial materials
- Research Institution
  The University of Tokyo
  National Institute of Advanced Industrial Science and Technology
  National Institute for Materials Science

All 2024 2023 2022 2021 2020 2019 2018 2017 2016

All Journal Article Presentation

[Journal Article] Computational Approach to Oxide Electrocatalysts2023
- Author(s)
  SUGINO Osamu、MUHAMMADY Shibghatullah、HARUYAMA Jun、KASAMATSU Shusuke
- Journal Title
  
  Vacuum and Surface Science
  
  Volume: 66 Issue: 6 Pages: 349-353
- DOI
  10.1380/vss.66.349
- ISSN
  2433-5835, 2433-5843
- Year and Date
  2023-06-10
- Language
  Japanese
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-20K15376
[Journal Article] First-principles study of water adsorption monolayer on Pt(111): Adsorption energy and second-order nonlinear susceptibility2023
- Author(s)
  Haruyama Jun、Sugimoto Toshiki、Sugino Osamu
- Journal Title
  
  Physical Review Materials
  
  Volume: 7 Issue: 11 Pages: 115803-115803
- DOI
  10.1103/physrevmaterials.7.115803
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-20K15376, KAKENHI-PROJECT-22H00296
[Journal Article] Theoretical Consideration of Side Reactions between the VS<sub>4</sub> Electrode and Carbonate Solvents in Lithium–metal Polysulfide Batteries2022
- Author(s)
  HAGIWARA Satoshi、HARUYAMA Jun、OTANI Minoru、UMEMURA Yuki、TAKEUCHI Tomonari、SAKAEBE Hikari
- Journal Title
  
  Electrochemistry
  
  Volume: 90 Issue: 10 Pages: 107002-107002
- DOI
  10.5796/electrochemistry.22-00087
- ISSN
  1344-3542, 2186-2451
- Year and Date
  2022-10-20
- Language
  English
- Peer Reviewed / Open Access
- Data Source
  KAKENHI-PROJECT-20K15376
[Journal Article] Effect of Nitrogen Doping and Oxygen Vacancy on the Oxygen Reduction Reaction on the Tetragonal Zirconia(101) Surface2022
- Author(s)
  Muhammady Shibghatullah、Haruyama Jun、Kasamatsu Shusuke、Sugino Osamu
- Journal Title
  
  The Journal of Physical Chemistry C
  
  Volume: 126 Issue: 37 Pages: 15662-15670
- DOI
  10.1021/acs.jpcc.2c04132
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-20K15376, KAKENHI-PLANNED-18H05519
[Journal Article] First-Principles Study for Water Adsorption Layers on Platinum Surface2022
- Author(s)
  HARUYAMA Jun、SUGIMOTO Toshiki、SUGINO Osamu
- Journal Title
  
  Vacuum and Surface Science
  
  Volume: 65 Issue: 8 Pages: 355-360
- DOI
  10.1380/vss.65.355
- ISSN
  2433-5835, 2433-5843
- Year and Date
  2022-08-10
- Language
  Japanese
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-20K15376, KAKENHI-PROJECT-22H00296, KAKENHI-PLANNED-18H05519
[Journal Article] Thermodynamic Analysis of Li-Intercalated Graphite by First-Principles Calculations with Vibrational and Configurational Contributions2021
- Author(s)
  Haruyama Jun、Takagi Shigeharu、Shimoda Keiji、Watanabe Iwao、Sodeyama Keitaro、Ikeshoji Tamio、Otani Minoru
- Journal Title
  
  The Journal of Physical Chemistry C
  
  Volume: 125 Issue: 51 Pages: 27891-27900
- DOI
  10.1021/acs.jpcc.1c08992
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-20K15376
[Journal Article] Comparative Study on Sulfide and Oxide Electrolyte Interfaces with Cathodes in All-Solid-State Battery via First-Principles Calculations2020
- Author(s)
  Okuno Yukihiro、Haruyama Jun、Tateyama Yoshitaka
- Journal Title
  
  ACS Applied Energy Materials
  
  Volume: 3 Issue: 11 Pages: 11061-11072
- DOI
  10.1021/acsaem.0c02033
- Peer Reviewed / Open Access
- Data Source
  KAKENHI-PROJECT-20K15376, KAKENHI-PLANNED-19H05815
[Journal Article] Two-Phase Reaction Mechanism for Fluorination and Defluorination in Fluoride-Shuttle Batteries: A First-Principles Study2019
- Author(s)
  Haruyama Jun、Okazaki Ken-ichi、Morita Yoshiyuki、Nakamoto Hirofumi、Matsubara Eiichiro、Ikeshoji Tamio、Otani Minoru
- Journal Title
  
  ACS Applied Materials & Interfaces
  
  Volume: 12 Issue: 1 Pages: 428-435
- DOI
  10.1021/acsami.9b13978
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-16K17969
[Journal Article] Liイオン電池電極界面の電荷移動過程の計算2019
- Author(s)
  春山潤、大谷実
- Journal Title
  
  セラミックス
  
  Volume: 54 Pages: 464-468
- Data Source
  KAKENHI-PROJECT-16K17969
[Journal Article] Analysis of Lithium Insertion/Desorption Reaction at Interfaces between Graphite Electrodes and Electrolyte Solution Using Density Functional + Implicit Solvation Theory2018
- Author(s)
  Jun Haruyama, Tamio Ikeshoji, Minoru Otani
- Journal Title
  
  The Journal of Physical Chemistry C
  
  Volume: 印刷中 Issue: 18 Pages: 9804-9810
- DOI
  10.1021/acs.jpcc.8b01979
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-16K17969
[Journal Article] Electrode potential from density functional theory calculations combined with implicit solvation theory2018
- Author(s)
  Haruyama Jun、Ikeshoji Tamio、Otani Minoru
- Journal Title
  
  Physical Review Materials
  
  Volume: 2 Issue: 9 Pages: 095801-095801
- DOI
  10.1103/physrevmaterials.2.095801
- Peer Reviewed
- Data Source
  KAKENHI-PROJECT-16K17969
[Journal Article] Cation Mixing Properties toward Co Diffusion at the LiCoO2 Cathode/ Sulfide Electrolyte Interface in a Solid-State Battery2017
- Author(s)
  Jun Haruyama, Keitaro Sodeyama, Yoshitaka Tateyama
- Journal Title
  
  ACS Appl. Mater. Interfaces
  
  Volume: 9 Issue: 1 Pages: 286-292
- DOI
  10.1021/acsami.6b08435
- Peer Reviewed / Acknowledgement Compliant
- Data Source
  KAKENHI-PROJECT-15K05138, KAKENHI-PROJECT-16K17969
[Journal Article] First-Principles Study of Electron Injection and Defects at the TiO2/ CH3NH3PbI3 Interface of Perovskite Solar Cells2017
- Author(s)
  Jun Haruyama, Keitaro Sodeyama, Ikutaro Hamada, Liyuan Han, Yoshitaka Tateyama
- Journal Title
  
  The Journal of Physical Chemistry Letters
  
  Volume: 8 Issue: 23 Pages: 5840-5847
- DOI
  10.1021/acs.jpclett.7b02622
- Peer Reviewed / Open Access
- Data Source
  KAKENHI-PROJECT-16K17969, KAKENHI-PROJECT-15K05138
[Presentation] First-principles study of monolayer ice on Pt(111): adsorption energy and second-order nonlinear susceptibility2024
- Author(s)
  Jun Haruyama, Osamu Sugino
- Organizer
  Workshop on “THz and SFG spectroscopy and related phenomena in Solid-State Physics and Surface Science"
- Data Source
  KAKENHI-PROJECT-20K15376
[Presentation] 第一原理分子動力学計算による Ba1.75LiH2.7O0.9のヒドリド拡散機構の解析2023
- Author(s)
  春山潤, 竹入史隆, 小林玄器, 杉野修
- Organizer
  第49回固体イオニクス討論会
- Data Source
  KAKENHI-PROJECT-20K15376
[Presentation] Pt(111)/表面 H2O 吸着層の二次非線形感受率の第一原理計算2023
- Author(s)
  春山潤, 杉本敏樹, 杉野修
- Organizer
  日本物理学会 2023年春季大会
- Data Source
  KAKENHI-PROJECT-20K15376
[Presentation] 金属表面単層吸着水の構造安定性・二次非線形感受率の第一原理計算2023
- Author(s)
  春山潤
- Organizer
  第6回レアイベント研究会ワークショップ
- Invited
- Data Source
  KAKENHI-PROJECT-20K15376
[Presentation] 第一原理分子動力学計算を用いたヒドリド伝導物質 Ba1.75LiH2.7O0.9 の解析2023
- Author(s)
  春山潤, 竹入史隆, 小林玄器, 杉野修
- Organizer
  日本物理学会第78回年次大会
- Data Source
  KAKENHI-PROJECT-20K15376
[Presentation] 摂動電場を用いた Pt(111)表面/水吸着層の二次非線形感受率の第一原理計算2023
- Author(s)
  春山潤, 杉本敏樹, 杉野修
- Organizer
  ISSPワークショップ「表面界面スペクトロスコピー2023」
- Data Source
  KAKENHI-PROJECT-20K15376
[Presentation] First-principles study of second-order nonlinear susceptibility of water adsorption layer on Pt(111) surface2023
- Author(s)
  Jun Haruyama, Toshiki Sugimoto, Osamu Sugino
- Organizer
  APS March Meeting 2023
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20K15376
[Presentation] 第一原理計算を用いた金属/吸着水系の二次非線形感受率の解析2023
- Author(s)
  春山潤, 杉本敏樹, 杉野修
- Organizer
  物性研究所スパコン共同利用・CCMS合同研究会「計算の時代における物性科学」
- Data Source
  KAKENHI-PROJECT-20K15376
[Presentation] First-Principles Studies for Hydride and Water2022
- Author(s)
  Jun Haruyama, Osamu Sugino
- Organizer
  第2回ハイドロジェノミクス国際会議
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20K15376
[Presentation] 第一原理計算を用いたPt(111)/表面吸着H2O構造の解析2022
- Author(s)
  春山潤,杉本敏樹, 杉野修
- Organizer
  日本物理学会第77回年次大会
- Data Source
  KAKENHI-PROJECT-20K15376
[Presentation] Adsorption Energies and Vibrational Properties of Water Adsorption Layer on Pt(111) Surface2022
- Author(s)
  Jun Haruyama, Toshiki Sugimoto, Osamu Sugino
- Organizer
  Psi-k conference
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20K15376
[Presentation] Pt表面のH2 吸着層構造の第一原理計算による解析2022
- Author(s)
  春山潤, 杉本敏樹, 杉野修
- Organizer
  物性研究所スパコン共同利用・CCMS合同研究会「計算物質科学の新展開」
- Data Source
  KAKENHI-PROJECT-20K15376
[Presentation] 第一原理計算を用いたPt(111)表面の単層氷構造の研究2022
- Author(s)
  春山潤,杉本敏樹, 杉野修
- Organizer
  2021年日本表面真空学会学術講演会
- Data Source
  KAKENHI-PROJECT-20K15376
[Presentation] Li挿入グラファイトの熱力学的安定性の第一原理計算2021
- Author(s)
  春山潤, 高木繁治, 下田景士, 渡邊巖, 袖山慶太郎, 池庄司民夫, 大谷実
- Organizer
  日本物理学会第76回年次大会
- Data Source
  KAKENHI-PROJECT-20K15376
[Presentation] 第一原理計算を用いたLi挿入グラファイトの熱力学的安定性の解析2021
- Author(s)
  春山潤, 高木繁治, 下田景士, 渡邊巖, 袖山慶太郎, 池庄司民夫, 大谷実
- Organizer
  第88回電気化学会
- Data Source
  KAKENHI-PROJECT-20K15376
[Presentation] 第一原理計算+溶液理論を用いたLiグラファイトの反応解析2021
- Author(s)
  春山潤
- Organizer
  PCoMS Symposium & Annual meeting of SCCMS 2020
- Invited
- Data Source
  KAKENHI-PROJECT-20K15376
[Presentation] 古典密度汎関数理論を用いたLennard-Jones・剛体球系の分布関数計算2020
- Author(s)
  春山潤, 杉野修
- Organizer
  日本物理学会2020年秋季大会
- Data Source
  KAKENHI-PROJECT-20K15376
[Presentation] 第一原理計算を用いたLi挿入グラファイトの安定性の解析2020
- Author(s)
  春山潤, 高木繁治, 下田景士, 渡邊巖, 袖山慶太郎, 池庄司民夫, 大谷実
- Organizer
  第61回電池討論会
- Data Source
  KAKENHI-PROJECT-20K15376
[Presentation] First-Principles Analysis for Phase Stability of Li-Intercalated Graphite in Li-Ion Battery2020
- Author(s)
  Jun Haruyama, Shigeharu Takagi, Keiji Shimoda, Iwao Watanabe, Keitaro Sodeyama, Tamio Ikeshoji, Minoru Otani
- Organizer
  PRiME 2020/238th ECS Meeting
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-20K15376
[Presentation] 計算科学によるLiイオン電池における界面の電荷移動反応の理解2020
- Author(s)
  春山潤
- Organizer
  日本学術振興会「先端ナノデバイス・材料ナノテクノロジー第151委員会」令和2年度第2回研究会
- Invited
- Data Source
  KAKENHI-PROJECT-20K15376
[Presentation] 古典密度汎関数理論を用いたLennard-Jones液体・剛体球系の分布関数計算2020
- Author(s)
  春山潤, 杉野修
- Organizer
  物性研究所スパコン共同利用・CCMS合同研究会
- Data Source
  KAKENHI-PROJECT-20K15376
[Presentation] 密度汎関数法と溶液理論を用いた電荷移動反応の解析2019
- Author(s)
  春山潤, 池庄司民夫, 大谷実
- Organizer
  物性研究所スパコン共同利用・CCMS合同研究会「計算物質科学の新展開」
- Data Source
  KAKENHI-PROJECT-16K17969
[Presentation] Electrode potential and charge transfer reaction using density functional theory combined with implicit solvation model2019
- Author(s)
  Jun Haruyama
- Organizer
  The 81st Okazaki Conference
- Invited / Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K17969
[Presentation] 古典密度汎関数理論を用いた溶液系の分布関数計算2019
- Author(s)
  春山潤, 杉野修
- Organizer
  日本物理学会2019年秋季大会
- Data Source
  KAKENHI-PROJECT-16K17969
[Presentation] Standard Hydrogen Electrode Potential from Density Functional + Implicit Solvation Theory2019
- Author(s)
  Jun Haruyama, Tamio Ikeshoji, and Minoru Otani
- Organizer
  Computational Sciences Workshop 2019
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K17969
[Presentation] Definition of Electrode Potential from Density Functional + Implicit Solvation Theory2019
- Author(s)
  Jun Haruyama, Tamio Ikeshoji, Minoru Otani
- Organizer
  10th Congress of the International Society of Theoretical Chemical Physics
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K17969
[Presentation] 密度汎関数法と溶液理論を用いた電荷移動反応の解析2019
- Author(s)
  春山潤, 池庄司民夫, 大谷実
- Organizer
  物性研スパコン共同利用CCMS合同研究会
- Invited
- Data Source
  KAKENHI-PROJECT-16K17969
[Presentation] Classical Density Functional Theory Calculations of Distribution Function of Ne Liquid2019
- Author(s)
  Jun Haruyama, Osamu Sugino
- Organizer
  the 22nd Asian Workshop on First-Principles Electronic Structure Calculations
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K17969
[Presentation] Li charge transfer simulation at graphite/solution interface using density functional calculation combined with implicit solvation model2019
- Author(s)
  Jun Haruyama, Tamio Ikeshoji, and Minoru Otani
- Organizer
  APS March Meeting 2019
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K17969
[Presentation] グラファイト/溶液界面におけるLi挿入・脱離反応の密度汎関数+溶液理論を用いた解析2018
- Author(s)
  春山潤, 池庄司民夫, 大谷実
- Organizer
  第59回電池討論会
- Data Source
  KAKENHI-PROJECT-16K17969
[Presentation] Simulations by density functional + implicit classical solvation theories for electrode/solution interfaces under an applied voltage2018
- Author(s)
  Jun Haruyama, Tamio Ikeshoji, Minoru Otani
- Organizer
  APS March Meeting 2018
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K17969
[Presentation] Theoretical Analysis of Li Insertion/Desorption Reaction at LixC6/1 M LiPF6 EC Solution Interface Using Density Functional + Implicit Solvation Model2018
- Author(s)
  Jun Haruyama, Tamio Ikeshoji, and Minoru Otani
- Organizer
  AiMES2018 ECS and SMEQ Joint International Meeting
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K17969
[Presentation] Standard Hydrogen Electrode Potential Referenced to Inner Potential from Density Functional + Implicit Solvation Theory2018
- Author(s)
  Jun Haruyama, Tamio Ikeshoji, and Minoru Otani
- Organizer
  AiMES2018 ECS and SMEQ Joint International Meeting
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K17969
[Presentation] 第一原理計算による全固体電池正極/電解質界面の界面抵抗に関する研究 (hp170169)2018
- Author(s)
  春山潤, 館山佳尚, 木野日織
- Organizer
  第5回HPCI成果報告会
- Data Source
  KAKENHI-PROJECT-16K17969
[Presentation] Li Insertion/Desorption Simulations at LixC6/EC (LiPF6 1M) Interfaces Using Density Functional + Implicit Solvation Theory2018
- Author(s)
  Jun Haruyama, Tamio Ikeshoji, Minoru Otani
- Organizer
  22nd Topical Meeting of the International Society of Electrochemistry
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K17969
[Presentation] 密度汎関数理論と溶液理論を用いたグラファイト/溶液界面におけるLi挿入・脱離のシミュレーション2018
- Author(s)
  春山潤, 池庄司民夫, 大谷実
- Organizer
  2018年電気化学秋季大会
- Data Source
  KAKENHI-PROJECT-16K17969
[Presentation] Electrochemical reaction simulations at metal/water interfaces using density functional + implicit classical solvation theory2017
- Author(s)
  Jun Haruyama, Minoru Otani
- Organizer
  The 8th International Symposium on Surface Science (ISSS8)
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K17969
[Presentation] Electrochemical reaction simulations at metal/water interfaces using density functional + implicit classical solvation theory2017
- Author(s)
  Jun Haruyama, Minoru Otani
- Organizer
  CPMD2017 Workshop
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K17969
[Presentation] 第一原理計算による全固体Liイオン電池のLiCoO2正極/硫化物電解質界面のCo拡散の研究2016
- Author(s)
  春山潤、袖山慶太郎、館山佳尚
- Organizer
  日本物理学会2016年秋季大会
- Place of Presentation
  金沢大学角間キャンパス(石川県金沢市)
- Year and Date
  2016-09-13
- Data Source
  KAKENHI-PROJECT-16K17969
[Presentation] 第一原理計算を用いたリチウムイオン全固体電池正極/電解質界面の研究 (hp150055)2016
- Author(s)
  春山潤、館山佳尚、木野日織
- Organizer
  第3回HPCI成果報告会
- Place of Presentation
  コクヨホール(東京都品川区)
- Data Source
  KAKENHI-PROJECT-16K17969
[Presentation] First-principles study for all-solid-state Li-ion battery and perovskite solar cell2016
- Author(s)
  Jun Haruyama, Keitaro Sodeyama, Yoshitaka Tateyama
- Organizer
  TIAポスター交流会
- Place of Presentation
  つくば国際会議場 (茨城県つくば市)
- Data Source
  KAKENHI-PROJECT-16K17969
[Presentation] First-Principles Study on LiCoO2/Sulfide Interfaces in All-Solid-State Li-Ion Battery: Space-Charge Layer and Interfacial Co Mixing2016
- Author(s)
  Jun Haruyama, Keitaro Sodeyama, Kazunori Takada, Yoshitaka Tateyama
- Organizer
  PRiME 2016/230th ECS Meeting
- Place of Presentation
  Hawaii Convention Center (Honolulu, Hawaii, US)
- Year and Date
  2016-10-03
- Int'l Joint Research
- Data Source
  KAKENHI-PROJECT-16K17969
[Presentation] 第一原理計算を用いた LiCoO2正極/Li3PS4電解質界面の Co拡散機構の研究2016
- Author(s)
  春山潤、袖山慶太郎、館山佳尚
- Organizer
  第57回電池討論会
- Place of Presentation
  幕張メッセ国際会議場(千葉県千葉市)
- Year and Date
  2016-11-29
- Data Source
  KAKENHI-PROJECT-16K17969

1. TATEYAMA Yoshitaka

# of Collaborated Projects: 0 results

# of Collaborated Products: 1 results

Haruyama Jun 春山 潤

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第一原理機械学習力場と分子動力学法を用いた超イオン伝導体の拡散・相転移挙動の研究Principal Investigator

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First-principles study of water adsorption layer on metal surfacePrincipal Investigator

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The study for charge transfer reaction in Li-ion battery using first-principles calculation combined with implicit salvation modelPrincipal Investigator

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First-Principles Study of Cathode/Electrolyte Interfaces for All-Solid-State Li-Ion BatteryPrincipal Investigator

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[Journal Article] Computational Approach to Oxide Electrocatalysts2023

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[Journal Article] First-principles study of water adsorption monolayer on Pt(111): Adsorption energy and second-order nonlinear susceptibility2023

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[Journal Article] Theoretical Consideration of Side Reactions between the VS<sub>4</sub> Electrode and Carbonate Solvents in Lithium–metal Polysulfide Batteries2022

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[Journal Article] Effect of Nitrogen Doping and Oxygen Vacancy on the Oxygen Reduction Reaction on the Tetragonal Zirconia(101) Surface2022

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[Journal Article] First-Principles Study for Water Adsorption Layers on Platinum Surface2022

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[Journal Article] Thermodynamic Analysis of Li-Intercalated Graphite by First-Principles Calculations with Vibrational and Configurational Contributions2021

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[Journal Article] Comparative Study on Sulfide and Oxide Electrolyte Interfaces with Cathodes in All-Solid-State Battery via First-Principles Calculations2020

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[Journal Article] Two-Phase Reaction Mechanism for Fluorination and Defluorination in Fluoride-Shuttle Batteries: A First-Principles Study2019

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[Journal Article] Liイオン電池電極界面の電荷移動過程の計算2019

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Haruyama Jun 春山潤

[Presentation] 金属表面単層吸着水の構造安定性・二次非線形感受率の第一原理計算2023

[Presentation] 第一原理分子動力学計算を用いたヒドリド伝導物質 Ba1.75LiH2.7O0.9 の解析2023