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密度汎関数理論または電子構造 (1)
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2460 件のレコードが見つかりました。
Artificial Intelligence‐Driven Nanoarchitectonics for Smart Targeted Drug Delivery
ジャーナル論文
著者
Hayeon Bae
(author) (
この著者で検索
)
Hayeon Bae
;
Hyunsub Ji
(author) (
この著者で検索
)
Hyunsub Ji
;
Konstantin Konstantinov
(author) (
この著者で検索
)
Konstantin Konstantinov
;
Ronald Sluyter
(author) (
この著者で検索
)
Ronald Sluyter
;
Katsuhiko Ariga
(author) (
この著者で検索
)
https://orcid.org/0000-0002-2445-2955
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Katsuhiko Ariga
;
Yong Ho Kim
(author) (
この著者で検索
)
Yong Ho Kim
;
Jung Ho Kim
(author) (
この著者で検索
)
Jung Ho Kim
キーワード
artificial intelligence
,
in silico optimization
,
machine learning
,
nanocarrier design
,
nanomedicine
,
targeted drug delivery
刊行年月日
2025-08-07
更新時刻
2025-10-28 12:30:13 +0900
Machine extraction of polymer data from tables using XML versions of scientific articles
データセット
著者
YOSHIZAWA, Atsushi
(author) (
この著者で検索
)
YOSHIZAWA, Atsushi
;
ISHII, Masashi
(author) (
この著者で検索
)
https://orcid.org/0000-0003-0357-2832
NIMS Researchers Directory SAMURAI
ISHII, Masashi
;
SHINDO, Hiroyuki
(author) (
この著者で検索
)
https://orcid.org/0000-0003-1081-9194
(unauthenticated)
SHINDO, Hiroyuki
;
OKA, Hiroyuki
(author) (
この著者で検索
)
https://orcid.org/0000-0002-1768-2429
NIMS Researchers Directory SAMURAI
OKA, Hiroyuki
;
MATSUMOTO, Yuji
(author) (
この著者で検索
)
https://orcid.org/0000-0003-4946-9574
(unauthenticated)
MATSUMOTO, Yuji
キーワード
polymer data
,
table
,
machine extraction
,
informatics
,
XML
刊行年月日
2021-01-01
更新時刻
2024-06-21 15:45:49 +0900
Subphase exploration for SmFe12-based permanent magnets by Gibbs energies obtained with first-principles cluster-expansion method
ジャーナル論文
著者
Satoru Enomoto
(author) (
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)
Satoru Enomoto
;
Sonju Kou
(author) (
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)
Sonju Kou
;
Taichi Abe
(author) (
この著者で検索
)
https://orcid.org/0000-0002-5065-0939
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Taichi Abe
;
Yoshihiro Gohda
(author) (
この著者で検索
)
Yoshihiro Gohda
キーワード
Phase stability
,
CALHPAD
,
Ab initio calculations
刊行年月日
2023-04-11
更新時刻
2025-04-16 08:30:24 +0900
Overview of gaseous hydrogen-assisted fatigue crack growth in ferritic iron and steels: Bridging micro and macro
ジャーナル論文
著者
Yuhei Ogawa
(author) (
この著者で検索
)
https://orcid.org/0000-0003-2713-9822
National Institute for Materials Science Research Center for Structural Materials
NIMS Researchers Directory SAMURAI
Yuhei Ogawa
;
Osamu Takakuwa
(author) (
この著者で検索
)
Kyushu University Department of Mechanical Engineering
Osamu Takakuwa
;
Akinobu Shibata
(author) (
この著者で検索
)
https://orcid.org/0000-0001-8577-6411
National Institute for Materials Science Research Center for Structural Materials
NIMS Researchers Directory SAMURAI
Akinobu Shibata
キーワード
Hydrogen embrittlement
,
Ferritic steel
,
Fatigue crack growth
,
Crack path
,
Deformation microstructure
刊行年月日
2025-01-18
更新時刻
2025-01-20 16:30:23 +0900
Achieving High Piezoelectric Performance across a Wide Composition Range in Tetragonal (Bi,Na)TiO
3
–BaTiO
3
Films for Micro-electromechanical Systems
ジャーナル論文
著者
Keisuke Ishihama
(author) (
この著者で検索
)
Keisuke Ishihama
;
Takao Shimizu
(author) (
この著者で検索
)
https://orcid.org/0000-0001-9508-7601
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Takao Shimizu
;
Kazuki Okamoto
(author) (
この著者で検索
)
Kazuki Okamoto
;
Akinori Tateyama
(author) (
この著者で検索
)
Akinori Tateyama
;
Wakiko Yamaoka
(author) (
この著者で検索
)
Wakiko Yamaoka
;
Risako Tsurumaru
(author) (
この著者で検索
)
Risako Tsurumaru
;
Shintaro Yoshimura
(author) (
この著者で検索
)
Shintaro Yoshimura
;
Yusuke Sato
(author) (
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)
Yusuke Sato
;
Hiroshi Funakubo
(author) (
この著者で検索
)
Hiroshi Funakubo
キーワード
Pb-free Piezoelectric film
,
domain switching
,
out-of-morphotropic phase boundary composition
,
tetragonal structure
刊行年月日
2024-01-10
更新時刻
2024-12-24 13:58:44 +0900
Observation of First-Order Quantum Phase Transitions and Ferromagnetism in Twisted Double Bilayer Graphene
ジャーナル論文
著者
Le Liu
(author) (
この著者で検索
)
Le Liu
;
Xin Lu
(author) (
この著者で検索
)
Xin Lu
;
Yanbang Chu
(author) (
この著者で検索
)
Yanbang Chu
;
Guang Yang
(author) (
この著者で検索
)
Guang Yang
;
Yalong Yuan
(author) (
この著者で検索
)
Yalong Yuan
;
Fanfan Wu
(author) (
この著者で検索
)
Fanfan Wu
;
Yiru Ji
(author) (
この著者で検索
)
Yiru Ji
;
Jinpeng Tian
(author) (
この著者で検索
)
Jinpeng Tian
;
Kenji Watanabe
(author) (
この著者で検索
)
https://orcid.org/0000-0003-3701-8119
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Kenji Watanabe
;
Takashi Taniguchi
(author) (
この著者で検索
)
https://orcid.org/0000-0002-1467-3105
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Takashi Taniguchi
;
Luojun Du
(author) (
この著者で検索
)
Luojun Du
;
Dongxia Shi
(author) (
この著者で検索
)
Dongxia Shi
;
Jianpeng Liu
(author) (
この著者で検索
)
Jianpeng Liu
;
Jie Shen
(author) (
この著者で検索
)
Jie Shen
;
Li Lu
(author) (
この著者で検索
)
Li Lu
;
Wei Yang
(author) (
この著者で検索
)
Wei Yang
;
Guangyu Zhang
(author) (
この著者で検索
)
Guangyu Zhang
キーワード
Twisted graphene
,
quantum phase transitions
,
ferromagnetism
刊行年月日
2023-08-07
更新時刻
2025-02-28 16:30:34 +0900
Lateral nanoarchitectonics from nano to life: ongoing challenges in interfacial chemical science
ジャーナル論文
著者
Jingwen Song
(author) (
この著者で検索
)
https://orcid.org/0000-0003-1910-9287
NIMS Researchers Directory SAMURAI
Jingwen Song
;
Anna Jancik-Prochazkova
(author) (
この著者で検索
)
https://orcid.org/0000-0002-6193-3694
(unauthenticated)
Anna Jancik-Prochazkova
;
Kohsaku Kawakami
(author) (
この著者で検索
)
https://orcid.org/0000-0002-3466-9365
NIMS Researchers Directory SAMURAI
Kohsaku Kawakami
;
Katsuhiko Ariga
(author) (
この著者で検索
)
https://orcid.org/0000-0002-2445-2955
NIMS Researchers Directory SAMURAI
Katsuhiko Ariga
キーワード
nanoarchitectonics
,
interface
,
Langmuir–Blodgett film
,
layer-by-layer assembly
,
biological membrane
刊行年月日
2024-10-28
更新時刻
2024-11-21 16:31:11 +0900
Few- and single-molecule reservoir computing experimentally demonstrated with surface-enhanced Raman scattering and ion gating
ジャーナル論文
著者
Daiki Nishioka
(author) (
この著者で検索
)
https://orcid.org/0000-0002-3369-7700
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Daiki Nishioka
;
Yoshitaka Shingaya
(author) (
この著者で検索
)
https://orcid.org/0000-0002-5926-3302
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Yoshitaka Shingaya
;
Takashi Tsuchiya
(author) (
この著者で検索
)
https://orcid.org/0000-0002-6950-6160
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Takashi Tsuchiya
;
Tohru Higuchi
(author) (
この著者で検索
)
Tohru Higuchi
;
Kazuya Terabe
(author) (
この著者で検索
)
https://orcid.org/0000-0003-3988-3456
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Kazuya Terabe
キーワード
Reservoir computing
,
Neuromorphic computing
,
Surface enhanced Raman scattering
,
Single-molecule reservoir computing
刊行年月日
2024-02-28
更新時刻
2024-08-05 12:30:19 +0900
Molecular design of phosphatidylserine-inspired polymers for efficient anti-inflammatory therapy via enhanced interaction with Tim-4
ジャーナル論文
著者
Kosuke Sato
(author) (
この著者で検索
)
National Institute for Materials Science
Kosuke Sato
;
Ahmed Nabil
(author) (
この著者で検索
)
Ahmed Nabil
;
Komol Kanta Sharker
(author) (
この著者で検索
)
Komol Kanta Sharker
;
Kouichi Shiraishi
(author) (
この著者で検索
)
Kouichi Shiraishi
;
Mitsuhiro Ebara
(author) (
この著者で検索
)
https://orcid.org/0000-0002-7906-0350
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Mitsuhiro Ebara
キーワード
phosphatidylserine
,
anti-inflammatory
,
Tim-4
,
MPS
刊行年月日
2026-01-09
更新時刻
2026-04-16 15:12:41 +0900
Defect passivation in methylammonium/bromine free inverted perovskite solar cells using charge-modulated molecular bonding
ジャーナル論文
著者
Dhruba B. Khadka
(author) (
この著者で検索
)
https://orcid.org/0000-0001-9134-3890
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Dhruba B. Khadka
;
Yasuhiro Shirai
(author) (
この著者で検索
)
https://orcid.org/0000-0003-2164-5468
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Yasuhiro Shirai
;
Masatoshi Yanagida
(author) (
この著者で検索
)
https://orcid.org/0000-0002-8065-7875
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Masatoshi Yanagida
;
Hitoshi Ota
(author) (
この著者で検索
)
https://orcid.org/0000-0002-8339-9592
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Hitoshi Ota
;
Andrey Lyalin
(author) (
この著者で検索
)
https://orcid.org/0000-0001-6589-0006
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Andrey Lyalin
;
Tetsuya Taketsugu
(author) (
この著者で検索
)
Tetsuya Taketsugu
;
Kenjiro Miyano
(author) (
この著者で検索
)
https://orcid.org/0000-0002-5869-3087
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Kenjiro Miyano
キーワード
Perovskite Solar Cells
,
MA-free
,
bifunctional molecule
,
piperazine
,
surface passivation
,
defect
,
device stability
刊行年月日
2024-01-29
更新時刻
2024-11-28 16:31:27 +0900
キーワード
Lattice thermal conductivity
(119)
functionally graded materials
(63)
thermoelectric
(54)
graphene
(30)
machine learning
(28)
2D materials
(24)
Machine learning
(22)
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(21)
transmission electron microscopy
(21)
hexagonal boron nitride
(19)
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(17)
nanomechanical sensors
(17)
Ga2O3
(16)
MoS2
(16)
atom probe tomography
(14)
spintronics
(14)
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(12)
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(12)
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(12)
diamond
(12)
gallium nitride
(12)
microstructure
(12)
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(11)
GaN
(11)
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(11)
organic semiconductor
(11)
thermal conductivity
(11)
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(10)
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(10)
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(10)
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(10)
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(9)
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(9)
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(9)
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(8)
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(8)
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(8)
Nb3Sn
(8)
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(8)
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(8)
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(8)
electronic structure
(8)
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(8)
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(8)
phosphor
(8)
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(8)
self-assembly
(8)
FePt
(7)
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(7)
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(7)
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(7)
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(7)
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(7)
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(7)
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(7)
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(7)
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(7)
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(6)
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(6)
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(6)
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(6)
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(6)
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(6)
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(6)
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(6)
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(6)
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(6)
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(6)
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(6)
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(6)
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(6)
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(6)
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(6)
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(6)
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(6)
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(6)
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(6)
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(6)
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(5)
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(5)
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(5)
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(5)
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(4)
RDEメタデータ定義
RDE送り状
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