10 件のレコードが見つかりました。

2505.07327v1.pdf
Nonrelativistic Piezomagnetic Effect in an Organic Altermagnet
ジャーナル論文
著者
Makoto Naka (author) (この著者で検索)
;
Yukitoshi Motome (author) (この著者で検索)
;
Tsuyoshi Miyazaki (author) (この著者で検索)
ORCID SAMURAI ;
Hitoshi Seo (author) (この著者で検索)
キーワード
Organic Altermagnet, Non-relativistic Piezomagnetic Effect
刊行年月日
2025-08-15
更新時刻
2025-11-11 08:30:06 +0900

3uHsAE-2410.20076v1.pdf
Quasi-One-Dimensional Spin Dynamics in a Molecular Spin Liquid System
ジャーナル論文
著者
Yugo Oshima (author) (この著者で検索)
ORCID ;
Yasuyuki Ishii (author) (この著者で検索)
ORCID ;
Francis L. Pratt (author) (この著者で検索)
ORCID ;
Isao Watanabe (author) (この著者で検索)
ORCID ;
Hitoshi Seo (author) (この著者で検索)
ORCID ;
Takao Tsumuraya (author) (この著者で検索)
ORCID ; ORCID SAMURAI ;
Reizo Kato (author) (この著者で検索)
ORCID
キーワード
Molecular Triangular Lattice System, 1D spin liquid, electron spin resonance, muon-spin relaxation measurements, DFT, extended Hubbard model
刊行年月日
2024-12-03
更新時刻
2024-12-06 17:17:56 +0900

jpsj.93.123704.pdf
Stability of Correlated Insulating States in Molecular Conductors from First-Principles Calculation
ジャーナル論文
著者
Takao Tsumuraya (author) (この著者で検索)
ORCID ; ORCID SAMURAI ;
Hitoshi Seo (author) (この著者で検索)
キーワード
First-principles calculations, Density Functional Theory, Molecular Conductors, Strongly Correlated Systems
刊行年月日
2024-12-15
更新時刻
2024-11-21 16:30:38 +0900

lin-et-al-2024-assessing-ni2(dobpdc)-anchoring-for-mitigating-lithium-polysulfide-dissolution-in-lithium-sulfur.pdf
Assessing Ni2(dobpdc) Anchoring for Mitigating Lithium Polysulfide Dissolution in Lithium–Sulfur Batteries
ジャーナル論文
著者
Kuan-Yu Lin (author) (この著者で検索)
ORCID ;
Mei-Ru Lai (author) (この著者で検索)
;
Minoru Otani (author) (この著者で検索)
;
Tsuyoshi Miyazaki (author) (この著者で検索)
ORCID SAMURAI ;
Jyh-Chiang Jiang (author) (この著者で検索)
キーワード
Li-S battery, DFT, 3D-RISM, MOF
刊行年月日
2024-10-03
更新時刻
2024-11-21 16:30:34 +0900

出版版:2024_PhysChemChemPhys_26_20251.pdf
Theoretical search for characteristic atoms in supported gold nanoparticles: a large-scale DFT study
ジャーナル論文
著者
Shengzhou Li (author) (この著者で検索)
ORCID SAMURAI ;
Tsuyoshi Miyazaki (author) (この著者で検索)
ORCID SAMURAI ;
Ayako Nakata (author) (この著者で検索)
ORCID SAMURAI
キーワード
Large-scale DFT, gold nanoparticle, supported nanoparticle, statistic analysis, density of states, principal component analysis, first-principles calculation
刊行年月日
2024-06-21
更新時刻
2024-08-31 08:30:29 +0900

Manuscript.docx
Unveiling dendrite-suppressing potential of alkali metal-based alloys in lithium metal batteries
ジャーナル論文
著者
Kuan-Yu Lin (author) (この著者で検索)
;
Rui-Tong Kuo (author) (この著者で検索)
;
Tsuyoshi Miyazaki (author) (この著者で検索)
ORCID SAMURAI ;
Bing Joe Hwang (author) (この著者で検索)
;
Jyh-Chiang Jiang (author) (この著者で検索)
キーワード
Li metal battery, DFT, solid electrolyte interface, MD
刊行年月日
2024-04-13
更新時刻
2024-08-20 10:48:14 +0900

d3cp06298h.pdf
Extraction of local structure differences in silica based on unsupervised learning
ジャーナル論文
著者
Anh Khoa Augustin Lu (author) (この著者で検索)
ORCID SAMURAI ;
Jianbo Lin (author) (この著者で検索)
National Institute for Materials Science
ORCID ;
Yasunori Futamura (author) (この著者で検索)
;
Tetsuya Sakurai (author) (この著者で検索)
;
Ryo Tamura (author) (この著者で検索)
ORCID SAMURAI ;
Tsuyoshi Miyazaki (author) (この著者で検索)
ORCID SAMURAI
キーワード
silica, unsupervised learning, Machine Learning, Molecular Dynamics(MD), Density Functional Theory (DFT), local structure analysis
刊行年月日
2024-03-28
更新時刻
2024-08-20 08:30:29 +0900

ACS_Main_text_rev_marked.pdf
Bioinspired Carbonized Polymer Microspheres for Full-Color Whispering Gallery Mode Emission for White Light Emission, Unclonable Anticounterfeiting, and Chemical Sensing Applications
ジャーナル論文
著者
Barun Kumar Barman (author) (この著者で検索)
ORCID SAMURAI ;
David Hernández-Pinilla (author) (この著者で検索)
;
Thang Duy Dao (author) (この著者で検索)
;
Kenzo Deguchi (author) (この著者で検索)
National Institute for Materials Science
;
Shinobu Ohki (author) (この著者で検索)
ORCID SAMURAI ;
Kenjiro Hashi (author) (この著者で検索)
ORCID SAMURAI ;
Atsushi Goto (author) (この著者で検索)
ORCID SAMURAI ;
Tsuyoshi Miyazaki (author) (この著者で検索)
ORCID SAMURAI ;
Karuna Kar Nanda (author) (この著者で検索)
ORCID ;
Tadaaki Nagao (author) (この著者で検索)
ORCID SAMURAI
キーワード
carbon dots, carbonized polymer microsphere, energy transfer, white-light emission, anti-counterfeiting
刊行年月日
2024-05-01
更新時刻
2025-05-01 08:30:21 +0900

1-s2.0-S0022309323005793-main.pdf
Large-scale DFT calculations of multi-component glass systems (SiO2)0.70(Al2O3)0.13(XO)0.17 (X = Mg, Ca, Sr, Ba) : Accuracy of classical force fields
ジャーナル論文
著者
Atsushi Tanaka (author) (この著者で検索)
;
Atsuki Saito (author) (この著者で検索)
;
Takashi Murata (author) (この著者で検索)
;
Ayako Nakata (author) (この著者で検索)
ORCID SAMURAI ;
Tsuyoshi Miyazaki (author) (この著者で検索)
ORCID SAMURAI
キーワード
Multi-component glass, First-principles calculations, Large-scale DFT, Classical force fields, Molecular dynamics simulations
刊行年月日
2023-11-25
更新時刻
2024-03-05 16:30:21 +0900

1-s2.0-S0008622324000332-main.pdf
An efficient cathode electrocatalyst for anion exchange membrane water electrolyzer
ジャーナル論文
著者
Shanmugam Ramakrishnan (author) (この著者で検索)
;
Subramanian Vijayapradeep (author) (この著者で検索)
;
Selva Chandrasekaran Selvaraj (author) (この著者で検索)
National Institute for Materials Science
ORCID ;
Jian Huang (author) (この著者で検索)
;
S.C. Karthikeyan (author) (この著者で検索)
;
Rambabu Gutru (author) (この著者で検索)
;
Natarajan Logeshwaran (author) (この著者で検索)
;
Tsuyoshi Miyazaki (author) (この著者で検索)
ORCID SAMURAI ;
Mohamed Mamlouk (author) (この著者で検索)
;
Dong Jin Yoo (author) (この著者で検索)
キーワード
Hierarchical MoS2, Pt–C core-shell, Density functional theory, In-situ Raman analysis, Anion exchange membrane water electrolyzer
刊行年月日
2024-01-15
更新時刻
2024-03-04 16:30:11 +0900