キーワード: machine learning
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74_Roadmap_J Phys Energy 2023_Roadmap on molecular modelling of electrochemical energy materials.pdf
2023 Roadmap on molecular modelling of electrochemical energy materials
ジャーナル論文
著者
Chao Zhang (author) (この著者で検索)
;
Jun Cheng (author) (この著者で検索)
;
Yiming Chen (author) (この著者で検索)
;
Maria K Y Chan (author) (この著者で検索)
;
Qiong Cai (author) (この著者で検索)
;
Rodrigo P Carvalho (author) (この著者で検索)
;
Cleber F N Marchiori (author) (この著者で検索)
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Daniel Brandell (author) (この著者で検索)
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C Moyses Araujo (author) (この著者で検索)
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Ming Chen (author) (この著者で検索)
;
Xiangyu Ji (author) (この著者で検索)
;
Guang Feng (author) (この著者で検索)
;
Kateryna Goloviznina (author) (この著者で検索)
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Alessandra Serva (author) (この著者で検索)
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Mathieu Salanne (author) (この著者で検索)
;
Toshihiko Mandai (author) (この著者で検索)
National Institute for Materials Science (NIMS)
ORCID SAMURAI ;
Tomooki Hosaka (author) (この著者で検索)
;
Mirna Alhanash (author) (この著者で検索)
;
Patrik Johansson (author) (この著者で検索)
;
Yun-Ze Qiu (author) (この著者で検索)
;
Hai Xiao (author) (この著者で検索)
;
Michael Eikerling (author) (この著者で検索)
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Ryosuke Jinnouchi (author) (この著者で検索)
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Marko M Melander (author) (この著者で検索)
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Georg Kastlunger (author) (この著者で検索)
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Assil Bouzid (author) (この著者で検索)
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Alfredo Pasquarello (author) (この著者で検索)
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Seung-Jae Shin (author) (この著者で検索)
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Minho M Kim (author) (この著者で検索)
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Hyungjun Kim (author) (この著者で検索)
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Kathleen Schwarz (author) (この著者で検索)
;
Ravishankar Sundararaman (author) (この著者で検索)
キーワード
electrochemical interfaces, density-functional theory, molecular dynamics simulation, electrochemical energy storage, machine learning, electrocatalysis
刊行年月日
2023-10-01
更新時刻
2024-03-22 00:53:39 +0900
jmca2024_NaSulfideConductor_esi_rj.pdf
Computational discovery of stable Na-ion sulfide solid electrolytes with high conductivity at room temperature
ジャーナル論文
著者
Seong-Hoon Jang (author) (この著者で検索)
ORCID ;
Randy Jalem (author) (この著者で検索)
National Institute for Materials Science
ORCID SAMURAI ;
Yoshitaka Tateyama (author) (この著者で検索)
National Institute for Materials Science
ORCID SAMURAI
キーワード
all solid state batteries, solid electrolytes, high-throughput first-principles calculation, computational materials search, machine learning, sodium ion conductors
刊行年月日
2024-08-05
更新時刻
2024-10-10 16:30:52 +0900
1-s2.0-S0364591624000877-main.pdf
Data-driven study of the enthalpy of mixing in the liquid phase
ジャーナル論文
著者
Guillaume Deffrennes (author) (この著者で検索)
ORCID ;
Bengt Hallstedt (author) (この著者で検索)
;
Taichi Abe (author) (この著者で検索)
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Quentin Bizot (author) (この著者で検索)
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Evelyne Fischer (author) (この著者で検索)
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Jean-Marc Joubert (author) (この著者で検索)
;
Kei Terayama (author) (この著者で検索)
; ORCID SAMURAI
キーワード
enthalpy of mixing, machine learning, liquid phase
刊行年月日
2024-09-25
更新時刻
2024-10-05 08:30:08 +0900
esi_clean.pdf
Multiobjective Solid Electrolyte Design of Tetragonal and Cubic Inverse-Perovskites for All-Solid-State Lithium-Ion Batteries by High-Throughput Density Functional Theory Calculations and AI-Driven Methods
ジャーナル論文
著者
JALEM Randy (author) (この著者で検索)
National Institute for Materials Science Research Center for Energy and Environmental Materials (GREEN)/Battery and Cell Materials Field/Interface Electrochemistry Group
ORCID SAMURAI ;
TATEYAMA Yoshitaka (author) (この著者で検索)
National Institute for Materials Science Research Center for Energy and Environmental Materials (GREEN)/Battery and Cell Materials Field/Interface Electrochemistry Group
ORCID SAMURAI ;
TAKADA Kazunori (author) (この著者で検索)
National Institute for Materials Science Research Center for Energy and Environmental Materials (GREEN)/Battery and Cell Materials Field/Solid-State Battery Group
ORCID SAMURAI ;
JANG Seonghoon (author) (この著者で検索)
National Institute for Materials Science Research Center for Energy and Environmental Materials (GREEN)/Battery and Cell Materials Field/Interface Electrochemistry Group
キーワード
all solid state batteries, solid electrolytes, density functional theory, materials informatics, machine learning, novel materials search
刊行年月日
2023-09-07
更新時刻
2024-08-28 08:30:15 +0900
d5dd00486a.pdf
Bayesian diversity control for batch-based phase diagram determination
ジャーナル論文
著者
Peiheng Zou (author) (この著者で検索)
; ORCID SAMURAI ; ORCID SAMURAI
キーワード
phase diagram, machine learning
刊行年月日
2026-02-16
更新時刻
2026-04-01 14:33:21 +0900
2604_supp_info.pdf
Non-negative matrix factorization analysis of spatially-resolved photoemission spectra for epitaxially grown graphene on SiC
ジャーナル論文
著者
Masaki Imamura (author) (この著者で検索)
Saga University Synchrotron Light Application Center
;
Kazutoshi Takahashi (author) (この著者で検索)
キーワード
Photoemission spectroscopy, non-negative matrix factorization, graphene, machine learning, data-driven analysis
刊行年月日
2026-06-19
更新時刻
2026-06-24 15:38:41 +0900
Supplementary information.pdf
Machine learning prediction of Young's modulus in multi component titanium based biomedical alloys using extended thermodynamic descriptors
ジャーナル論文
著者
Hassan Ahmad (author) (この著者で検索)
Pakistan Institute of Engineering and Applied Sciences (PIEAS) Department of Metallurgy and Materials Engineering
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Muhammad Haider (author) (この著者で検索)
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Zafar Iqbal (author) (この著者で検索)
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Muhammad Zarif (author) (この著者で検索)
;
Syed Mujtaba Ul Hassan (author) (この著者で検索)
キーワード
Titanium alloys, machine learning, biomedical alloys, Young’s modulus prediction
刊行年月日
2026-12-31
更新時刻
2026-07-08 16:58:38 +0900
Abstract_YenJu Wu.docx
Designing Thermal Insulating thin films with Data-Driven Innovation
プレゼンテーション
著者
Yen-Ju Wu (author) (この著者で検索)
National Institute for Materials Science Center for Basic Research on Materials/Data-driven Materials Research Field/Data-driven Inorganic Materials Group
ORCID SAMURAI ;
Yibin Xu (author) (この著者で検索)
National Institute for Materials Science Center for Basic Research on Materials/Data-driven Materials Research Field/Data-driven Inorganic Materials Group
ORCID SAMURAI
キーワード
Interfacial thermal resistance, machine learning, thermal insulator, thin film
刊行年月日
更新時刻
2025-03-12 16:30:31 +0900
3-12-Revised Manuscript without Any Highlighting.docx
Machine-Learning-Driven Discovery of Mn4+-Doped Red-Emitting Fluorides with Short Excited-State Lifetime and High Efficiency for Mini Light-Emitting Diode Displays
ジャーナル論文
著者
Hong Ming (author) (この著者で検索)
ORCID ;
Yayun Zhou (author) (この著者で検索)
;
Maxim S. Molokeev (author) (この著者で検索)
ORCID ;
Chuang Zhang (author) (この著者で検索)
;
Lin Huang (author) (この著者で検索)
;
Yuanjing Wang (author) (この著者で検索)
; ORCID SAMURAI ;
Enhai Song (author) (この著者で検索)
ORCID ;
Qinyuan Zhang (author) (この著者で検索)
ORCID
キーワード
luminescent materials, machine learning
刊行年月日
2024-05-06
更新時刻
2025-04-03 08:30:20 +0900
Dielectric tensor of perovskite oxides at finite temperature using equivariant graph neural network potentials.pdf
Dielectric tensor of perovskite oxides at finite temperature using equivariant graph neural network potentials
ジャーナル論文
著者
Alex Kutana (author) (この著者で検索)
Nagoya University
;
Koki Yoshimochi (author) (この著者で検索)
;
Ryoji Asahi (author) (この著者で検索)
キーワード
Graph neural network, machine learning, dielectrics, perovskite oxides, phase transitions
刊行年月日
2025-12-31
更新時刻
2025-07-18 10:24:15 +0900