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Article and Dataset
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Resource type
Journal article(20)
Dataset(1)
Keyword
machine learning (21)
tdm (3)
all solid state batteries (2)
inelastic mean free path (2)
solid electrolytes (2)
superconductors (2)
thermal conductivity (2)
Eu2+ (1)
Graph neural network (1)
LASSO (1)
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Creative Commons BY Attribution 4.0 International (11)
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https://creativecommons.org/licenses/by-nc/3.0/legalcode (1)
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application/pdf (18)
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chemical/x-cif (1)
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Keyword: machine learning
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21 records found.
Supercon 2 Dataset
Dataset
Creator
Foppiano, Luca
(author) (
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)
https://orcid.org/0000-0002-6114-6164
Foppiano, Luca
Keyword
superconductors
,
machine learning
,
dataset
,
tdm
,
materials science
Date published
2022-09-10
Updated at
2022-10-18 10:11:01 +0900
2023 Roadmap on molecular modelling of electrochemical energy materials
Journal article
Creator
Chao Zhang
(author) (
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)
Chao Zhang
;
Jun Cheng
(author) (
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)
Jun Cheng
;
Yiming Chen
(author) (
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)
Yiming Chen
;
Maria K Y Chan
(author) (
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)
Maria K Y Chan
;
Qiong Cai
(author) (
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)
Qiong Cai
;
Rodrigo P Carvalho
(author) (
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)
Rodrigo P Carvalho
;
Cleber F N Marchiori
(author) (
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)
Cleber F N Marchiori
;
Daniel Brandell
(author) (
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)
Daniel Brandell
;
C Moyses Araujo
(author) (
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)
C Moyses Araujo
;
Ming Chen
(author) (
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)
Ming Chen
;
Xiangyu Ji
(author) (
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)
Xiangyu Ji
;
Guang Feng
(author) (
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)
Guang Feng
;
Kateryna Goloviznina
(author) (
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)
Kateryna Goloviznina
;
Alessandra Serva
(author) (
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)
Alessandra Serva
;
Mathieu Salanne
(author) (
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)
Mathieu Salanne
;
Toshihiko Mandai
(author) (
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)
https://orcid.org/0000-0002-2403-7794
National Institute for Materials Science (NIMS)
NIMS Researchers Directory SAMURAI
Toshihiko Mandai
;
Tomooki Hosaka
(author) (
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)
Tomooki Hosaka
;
Mirna Alhanash
(author) (
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)
Mirna Alhanash
;
Patrik Johansson
(author) (
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Patrik Johansson
;
Yun-Ze Qiu
(author) (
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)
Yun-Ze Qiu
;
Hai Xiao
(author) (
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Hai Xiao
;
Michael Eikerling
(author) (
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Michael Eikerling
;
Ryosuke Jinnouchi
(author) (
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Ryosuke Jinnouchi
;
Marko M Melander
(author) (
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Marko M Melander
;
Georg Kastlunger
(author) (
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Georg Kastlunger
;
Assil Bouzid
(author) (
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Assil Bouzid
;
Alfredo Pasquarello
(author) (
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Alfredo Pasquarello
;
Seung-Jae Shin
(author) (
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)
Seung-Jae Shin
;
Minho M Kim
(author) (
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)
Minho M Kim
;
Hyungjun Kim
(author) (
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)
Hyungjun Kim
;
Kathleen Schwarz
(author) (
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)
Kathleen Schwarz
;
Ravishankar Sundararaman
(author) (
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)
Ravishankar Sundararaman
Keyword
electrochemical interfaces
,
density-functional theory
,
molecular dynamics simulation
,
electrochemical energy storage
,
machine learning
,
electrocatalysis
Date published
2023-10-01
Updated at
2024-03-22 00:53:39 +0900
Artificial Intelligence‐Driven Nanoarchitectonics for Smart Targeted Drug Delivery
Journal article
Creator
Hayeon Bae
(author) (
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)
Hayeon Bae
;
Hyunsub Ji
(author) (
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)
Hyunsub Ji
;
Konstantin Konstantinov
(author) (
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)
Konstantin Konstantinov
;
Ronald Sluyter
(author) (
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)
Ronald Sluyter
;
Katsuhiko Ariga
(author) (
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)
https://orcid.org/0000-0002-2445-2955
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Katsuhiko Ariga
;
Yong Ho Kim
(author) (
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)
Yong Ho Kim
;
Jung Ho Kim
(author) (
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)
Jung Ho Kim
Keyword
artificial intelligence
,
in silico optimization
,
machine learning
,
nanocarrier design
,
nanomedicine
,
targeted drug delivery
Date published
2025-08-07
Updated at
2025-10-28 12:30:13 +0900
Graph Network-Based Simulation of Multicellular Dynamics Driven by Concentrated Polymer Brush-Modified Cellulose Nanofibers
Journal article
Creator
Chiaki Yoshikawa
(author) (
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)
https://orcid.org/0000-0002-6589-387X
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Chiaki Yoshikawa
;
Duc Anh Nguyen
(author) (
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)
Duc Anh Nguyen
;
Tadashi Nakaji-Hirabayashi
(author) (
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)
Tadashi Nakaji-Hirabayashi
;
Ichigaku Takigawa
(author) (
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)
Ichigaku Takigawa
;
Hiroshi Mamitsuka
(author) (
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)
Hiroshi Mamitsuka
Keyword
cellulose nanofiber
,
concentrated polymer brush
,
hMSC
,
self-assembly
,
machine learning
Date published
2024-04-08
Updated at
2024-08-27 08:30:31 +0900
Machine-learning-assisted discovery of polymers with high thermal conductivity using a molecular design algorithm
Journal article
Creator
Stephen Wu
(author) (
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)
Stephen Wu
;
Yukiko Kondo
(author) (
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)
Yukiko Kondo
;
Masa-aki Kakimoto
(author) (
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)
Masa-aki Kakimoto
;
Bin Yang
(author) (
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)
Bin Yang
;
Hironao Yamada
(author) (
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)
Hironao Yamada
;
Isao Kuwajima
(author) (
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)
https://orcid.org/0000-0002-5994-3834
NIMS Researchers Directory SAMURAI
Isao Kuwajima
;
Guillaume Lambard
(author) (
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)
https://orcid.org/0000-0003-0275-4079
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Guillaume Lambard
;
Kenta Hongo
(author) (
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)
Kenta Hongo
;
Yibin Xu
(author) (
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)
https://orcid.org/0000-0001-8600-8748
NIMS Researchers Directory SAMURAI
Yibin Xu
;
Junichiro Shiomi
(author) (
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)
Junichiro Shiomi
;
Christoph Schick
(author) (
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)
Christoph Schick
;
Junko Morikawa
(author) (
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)
Junko Morikawa
;
Ryo Yoshida
(author) (
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)
Ryo Yoshida
Keyword
machine learning
,
polymer
,
thermal conductivity
,
molecular design
Date published
2019-06-21
Updated at
2024-11-21 16:31:23 +0900
Discovery of liquid crystalline polymers with high thermal conductivity using machine learning
Journal article
Creator
Hayato Maeda
(author) (
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)
https://orcid.org/0009-0004-1662-8000
(unauthenticated)
Hayato Maeda
;
Stephen Wu
(author) (
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)
https://orcid.org/0000-0002-7847-8106
(unauthenticated)
Stephen Wu
;
Rika Marui
(author) (
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)
https://orcid.org/0009-0009-2506-1196
(unauthenticated)
Rika Marui
;
Erina Yoshida
(author) (
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)
Erina Yoshida
;
Kan Hatakeyama-Sato
(author) (
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)
Kan Hatakeyama-Sato
;
Yuta Nabae
(author) (
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Yuta Nabae
;
Shiori Nakagawa
(author) (
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Shiori Nakagawa
;
Meguya Ryu
(author) (
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)
Meguya Ryu
;
Ryohei Ishige
(author) (
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)
Ryohei Ishige
;
Yoh Noguchi
(author) (
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)
Yoh Noguchi
;
Yoshihiro Hayashi
(author) (
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)
https://orcid.org/0000-0002-7650-4083
(unauthenticated)
Yoshihiro Hayashi
;
Masashi Ishii
(author) (
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)
https://orcid.org/0000-0003-0357-2832
NIMS Researchers Directory SAMURAI
Masashi Ishii
;
Isao Kuwajima
(author) (
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)
https://orcid.org/0000-0002-5994-3834
NIMS Researchers Directory SAMURAI
Isao Kuwajima
;
Felix Jiang
(author) (
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Felix Jiang
;
Xuan Thang Vu
(author) (
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Xuan Thang Vu
;
Sven Ingebrandt
(author) (
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https://orcid.org/0000-0002-0405-2727
(unauthenticated)
Sven Ingebrandt
;
Masatoshi Tokita
(author) (
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Masatoshi Tokita
;
Junko Morikawa
(author) (
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https://orcid.org/0000-0002-9530-9478
(unauthenticated)
Junko Morikawa
;
Ryo Yoshida
(author) (
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)
https://orcid.org/0000-0001-8092-0162
(unauthenticated)
Ryo Yoshida
;
Teruaki Hayakawa
(author) (
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)
Teruaki Hayakawa
Keyword
liquid crystalline polymer
,
thermal conductivity
,
machine learning
,
PoLyInfo
Date published
2025-07-02
Updated at
2025-08-19 12:30:21 +0900
Computational discovery of stable Na-ion sulfide solid electrolytes with high conductivity at room temperature
Journal article
Creator
Seong-Hoon Jang
(author) (
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)
https://orcid.org/0000-0001-6026-636X
(unauthenticated)
Seong-Hoon Jang
;
Randy Jalem
(author) (
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)
https://orcid.org/0000-0001-9505-771X
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Randy Jalem
;
Yoshitaka Tateyama
(author) (
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)
https://orcid.org/0000-0002-5532-6134
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Yoshitaka Tateyama
Keyword
all solid state batteries
,
solid electrolytes
,
high-throughput first-principles calculation
,
computational materials search
,
machine learning
,
sodium ion conductors
Date published
2024-08-05
Updated at
2024-10-10 16:30:52 +0900
Multi-Objective Optimization of Adhesive Joint Strength and Elastic Modulus of Adhesive Epoxy with Active Learning
Journal article
Creator
Paripat Kraisornkachit
(author) (
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)
https://orcid.org/0000-0002-0796-3665
NIMS Researchers Directory SAMURAI
Paripat Kraisornkachit
;
Masanobu Naito
(author) (
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)
https://orcid.org/0000-0001-7198-819X
NIMS Researchers Directory SAMURAI
Masanobu Naito
;
Chao Kang
(author) (
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)
https://orcid.org/0000-0002-9567-0976
(unauthenticated)
Chao Kang
;
Chiaki Sato
(author) (
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)
Chiaki Sato
Keyword
experimental testing
,
multi-objective optimization
,
epoxy
,
adhesive
,
elastic modulus
,
machine learning
,
active learning
Date published
2024-06-12
Updated at
2025-01-07 08:30:26 +0900
Self-Energy Spectroscopy and Artificial Neural Network
Journal article
Creator
Youhei Yamaji
(author) (
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)
https://orcid.org/0000-0002-4055-8792
NIMS Researchers Directory SAMURAI
Youhei Yamaji
Keyword
machine learning
,
quantum materials
,
photoemission spectroscopy
,
high-temperature superconductivity
Date published
2025-03-15
Updated at
2025-02-27 12:30:42 +0900
Machine Learning as a “Catalyst” for Advancements in Carbon Nanotube Research
Journal article
Creator
Guohai Chen
(author) (
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)
https://orcid.org/0000-0001-8481-0972
(unauthenticated)
Guohai Chen
;
Dai-Ming Tang
(author) (
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)
https://orcid.org/0000-0001-7136-7481
NIMS Researchers Directory SAMURAI
Dai-Ming Tang
Keyword
machine learning
,
carbon nanotube
,
in situ TEM
,
growth mechanism
Date published
2024-10-22
Updated at
2024-12-24 13:58:23 +0900
Keyword
machine learning
(21)
tdm
(3)
all solid state batteries
(2)
inelastic mean free path
(2)
solid electrolytes
(2)
superconductors
(2)
thermal conductivity
(2)
Eu2+
(1)
Graph neural network
(1)
LASSO
(1)
PoLyInfo
(1)
Time-domain thermoreflectance
(1)
active learning
(1)
adhesive
(1)
artificial intelligence
(1)
biomass
(1)
carbon
(1)
carbon nanotube
(1)
cellulose nanofiber
(1)
computational materials search
(1)
concentrated polymer brush
(1)
database
(1)
dataset
(1)
density functional theory
(1)
density-functional theory
(1)
dielectrics
(1)
dopant
(1)
elastic modulus
(1)
electrocatalysis
(1)
electrochemical energy storage
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electrochemical interfaces
(1)
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energy
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hMSC
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(1)
interfacial thermal resistance
(1)
liquid crystalline polymer
(1)
lithium metal battery
(1)
luminescence
(1)
luminescent materials
(1)
materials design
(1)
materials informatics
(1)
materials science
(1)
materials science
(1)
molecular design
(1)
molecular dynamics simulation
(1)
multi-objective optimization
(1)
multiple delay
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nanocarrier design
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nanomedicine
(1)
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perovskite oxides
(1)
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polymer
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self-assembly
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sodium ion conductors
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(1)
targeted drug delivery
(1)
thermal effusivity
(1)
thin film
(1)
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