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計算手法
https://matvoc.nims.go.jp/entity/Q21 (1)
密度汎関数理論または電子構造 (1)
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8240 件のレコードが見つかりました。
Rigidity‐Driven Structural Isomers in the NaCl–Ga
2
S
3
System: Implications for Energy Storage
ジャーナル論文
著者
Maria Bokova
(author) (
この著者で検索
)
https://orcid.org/0000-0002-2419-1644
(unauthenticated)
Maria Bokova
;
Mohammad Kassem
(author) (
この著者で検索
)
https://orcid.org/0000-0003-0512-0004
(unauthenticated)
Mohammad Kassem
;
Takeshi Usuki
(author) (
この著者で検索
)
Takeshi Usuki
;
Andrey Tverjanovich
(author) (
この著者で検索
)
https://orcid.org/0000-0002-0795-8188
(unauthenticated)
Andrey Tverjanovich
;
Anton Sokolov
(author) (
この著者で検索
)
Anton Sokolov
;
Daniele Fontanari
(author) (
この著者で検索
)
Daniele Fontanari
;
Alex C. Hannon
(author) (
この著者で検索
)
https://orcid.org/0000-0001-5914-1295
(unauthenticated)
Alex C. Hannon
;
Chris J. Benmore
(author) (
この著者で検索
)
https://orcid.org/0000-0001-7007-7749
(unauthenticated)
Chris J. Benmore
;
Igor Alekseev
(author) (
この著者で検索
)
Igor Alekseev
;
Shinji Kohara
(author) (
この著者で検索
)
https://orcid.org/0000-0001-9596-2680
NIMS Researchers Directory SAMURAI
Shinji Kohara
;
Pascal Roussel
(author) (
この著者で検索
)
https://orcid.org/0000-0001-7243-7293
(unauthenticated)
Pascal Roussel
;
Maxim Khomenko
(author) (
この著者で検索
)
Maxim Khomenko
;
Koji Ohara
(author) (
この著者で検索
)
https://orcid.org/0000-0002-3134-512X
(unauthenticated)
Koji Ohara
;
Yohei Onodera
(author) (
この著者で検索
)
https://orcid.org/0000-0002-3080-6991
NIMS Researchers Directory SAMURAI
Yohei Onodera
;
Arnaud Cuisset
(author) (
この著者で検索
)
https://orcid.org/0000-0002-4358-2819
(unauthenticated)
Arnaud Cuisset
;
Eugene Bychkov
(author) (
この著者で検索
)
https://orcid.org/0000-0002-3292-1205
(unauthenticated)
Eugene Bychkov
キーワード
all-solid-state batteries
,
neutron diffraction
,
X-ray diffraction
刊行年月日
2024-10-01
更新時刻
2024-10-25 16:30:19 +0900
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
Hassan Ahmad
;
Muhammad Haider
(author) (
この著者で検索
)
Muhammad Haider
;
Zafar Iqbal
(author) (
この著者で検索
)
Zafar Iqbal
;
Muhammad Zarif
(author) (
この著者で検索
)
Muhammad Zarif
;
Syed Mujtaba Ul Hassan
(author) (
この著者で検索
)
Syed Mujtaba Ul Hassan
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
Thermodynamic Evaluation of the Fe-Zn Binary System with Reference to the Latest Experimental Phase Diagram
ジャーナル論文
著者
Ikuo Ohnuma
(author) (
この著者で検索
)
https://orcid.org/0000-0003-4874-4941
NIMS Researchers Directory SAMURAI
Ikuo Ohnuma
;
Kwangsik Han
(author) (
この著者で検索
)
Kwangsik Han
;
Inho Lee
(author) (
この著者で検索
)
Inho Lee
;
Takako Yamashita
(author) (
この著者で検索
)
Takako Yamashita
;
Ryosuke Kainuma
(author) (
この著者で検索
)
Ryosuke Kainuma
キーワード
CALPHAD
,
phase equilibria
,
hot-dip galvanizing
,
thermodynamics
刊行年月日
2024-05-05
更新時刻
2025-05-05 08:30:07 +0900
Quantum Dynamics of Attractive and Repulsive Polarons in a Doped
MoSe
2
Monolayer
ジャーナル論文
著者
Di Huang
(author) (
この著者で検索
)
Di Huang
;
Kevin Sampson
(author) (
この著者で検索
)
Kevin Sampson
;
Yue Ni
(author) (
この著者で検索
)
Yue Ni
;
Zhida Liu
(author) (
この著者で検索
)
Zhida Liu
;
Danfu Liang
(author) (
この著者で検索
)
Danfu Liang
;
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
;
Hebin Li
(author) (
この著者で検索
)
Hebin Li
;
Eric Martin
(author) (
この著者で検索
)
Eric Martin
;
Jesper Levinsen
(author) (
この著者で検索
)
Jesper Levinsen
;
Meera M. Parish
(author) (
この著者で検索
)
Meera M. Parish
;
Emanuel Tutuc
(author) (
この著者で検索
)
Emanuel Tutuc
;
Dmitry K. Efimkin
(author) (
この著者で検索
)
Dmitry K. Efimkin
;
Xiaoqin Li
(author) (
この著者で検索
)
Xiaoqin Li
キーワード
Fermi polarons
,
MoSe2 monolayer
,
quantum dynamics
刊行年月日
2023-03-02
更新時刻
2025-02-23 22:47:02 +0900
Robust fractional quantum Hall effect in the N=2 Landau level in bilayer graphene
ジャーナル論文
著者
Georgi Diankov
(author) (
この著者で検索
)
Georgi Diankov
;
Chi-Te Liang
(author) (
この著者で検索
)
Chi-Te Liang
;
François Amet
(author) (
この著者で検索
)
François Amet
;
Patrick Gallagher
(author) (
この著者で検索
)
Patrick Gallagher
;
Menyoung Lee
(author) (
この著者で検索
)
Menyoung Lee
;
Andrew J. Bestwick
(author) (
この著者で検索
)
Andrew J. Bestwick
;
Kevin Tharratt
(author) (
この著者で検索
)
Kevin Tharratt
;
William Coniglio
(author) (
この著者で検索
)
William Coniglio
;
Jan Jaroszynski
(author) (
この著者で検索
)
Jan Jaroszynski
;
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
;
David Goldhaber-Gordon
(author) (
この著者で検索
)
David Goldhaber-Gordon
キーワード
Fractional quantum Hall effect
,
bilayer graphene
,
electron interactions
刊行年月日
2016-12-21
更新時刻
2025-02-27 08:31:18 +0900
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
)
https://orcid.org/0000-0002-3752-2537
(unauthenticated)
Guillaume Deffrennes
;
Bengt Hallstedt
(author) (
この著者で検索
)
Bengt Hallstedt
;
Taichi Abe
(author) (
この著者で検索
)
Taichi Abe
;
Quentin Bizot
(author) (
この著者で検索
)
Quentin Bizot
;
Evelyne Fischer
(author) (
この著者で検索
)
Evelyne Fischer
;
Jean-Marc Joubert
(author) (
この著者で検索
)
Jean-Marc Joubert
;
Kei Terayama
(author) (
この著者で検索
)
Kei Terayama
;
Ryo Tamura
(author) (
この著者で検索
)
https://orcid.org/0000-0002-0349-358X
NIMS Researchers Directory SAMURAI
Ryo Tamura
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
Thermodynamic Investigation of MnAl
2
O
4
Spinel Precipitation Behavior in Manganese Containing-Slag Systems
ジャーナル論文
著者
Chonglin Shi
(author) (
この著者で検索
)
https://orcid.org/0009-0008-3856-1387
(unauthenticated)
Chonglin Shi
;
Yuxing Liu
(author) (
この著者で検索
)
https://orcid.org/0000-0002-1735-5663
(unauthenticated)
Yuxing Liu
;
Kentaro Urata
(author) (
この著者で検索
)
https://orcid.org/0009-0000-3175-6407
(unauthenticated)
Kentaro Urata
;
Shintaro Yasui
(author) (
この著者で検索
)
https://orcid.org/0000-0003-0524-9318
(unauthenticated)
Shintaro Yasui
;
Taichi Abe
(author) (
この著者で検索
)
https://orcid.org/0000-0002-5065-0939
NIMS Researchers Directory SAMURAI
Taichi Abe
;
Yoshinao Kobayashi
(author) (
この著者で検索
)
Yoshinao Kobayashi
キーワード
Thermodynamic analysis
,
MnAl2O4
,
CaO-SiO2-MgO-FeO-MnO-Al2O3 slag
,
Precipitation behavior
刊行年月日
2025-12-15
更新時刻
2025-12-25 15:09:33 +0900
Quantifying the Thresholds of the Phospholipid Surface Density for Nonspecific Protein Adsorption and Desorption at the Triacylglycerol/Water Interface
ジャーナル論文
著者
Chiho Kataoka-Hamai
(author) (
この著者で検索
)
https://orcid.org/0000-0002-4068-0405
NIMS Researchers Directory SAMURAI
Chiho Kataoka-Hamai
キーワード
Lipid droplets
,
triacylglycerol
,
oil/water interface
,
protein
刊行年月日
2025-09-23
更新時刻
2025-09-24 16:30:20 +0900
Quantifying the Thresholds of the Phospholipid Surface Density for Nonspecific Protein Adsorption and Desorption at the Triacylglycerol/Water Interface
データセット
著者
Chiho Kataoka-Hamai
(author) (
この著者で検索
)
https://orcid.org/0000-0002-4068-0405
NIMS Researchers Directory SAMURAI
Chiho Kataoka-Hamai
キーワード
Lipid droplets
,
triacylglycerol
,
oil/water interface
,
protein
刊行年月日
2025-09-23
更新時刻
2025-09-24 16:30:26 +0900
Built-in Bernal gap in large-angle-twisted monolayer-bilayer graphene
ジャーナル論文
著者
Alex Boschi
(author) (
この著者で検索
)
https://orcid.org/0000-0001-7562-7340
(unauthenticated)
Alex Boschi
;
Zewdu M. Gebeyehu
(author) (
この著者で検索
)
Zewdu M. Gebeyehu
;
Sergey Slizovskiy
(author) (
この著者で検索
)
https://orcid.org/0000-0003-0131-0775
(unauthenticated)
Sergey Slizovskiy
;
Vaidotas Mišeikis
(author) (
この著者で検索
)
https://orcid.org/0000-0001-6263-4250
(unauthenticated)
Vaidotas Mišeikis
;
Stiven Forti
(author) (
この著者で検索
)
https://orcid.org/0000-0002-8939-3175
(unauthenticated)
Stiven Forti
;
Antonio Rossi
(author) (
この著者で検索
)
https://orcid.org/0000-0003-4574-7215
(unauthenticated)
Antonio Rossi
;
Kenji Watanabe
(author) (
この著者で検索
)
https://orcid.org/0000-0003-3701-8119
NIMS Researchers Directory SAMURAI
Kenji Watanabe
;
Takashi Taniguchi
(author) (
この著者で検索
)
https://orcid.org/0000-0002-1467-3105
NIMS Researchers Directory SAMURAI
Takashi Taniguchi
;
Fabio Beltram
(author) (
この著者で検索
)
Fabio Beltram
;
Vladimir I. Fal’ko
(author) (
この著者で検索
)
https://orcid.org/0000-0003-0828-0310
(unauthenticated)
Vladimir I. Fal’ko
;
Camilla Coletti
(author) (
この著者で検索
)
https://orcid.org/0000-0002-8134-7633
(unauthenticated)
Camilla Coletti
;
Sergio Pezzini
(author) (
この著者で検索
)
https://orcid.org/0000-0003-4289-907X
(unauthenticated)
Sergio Pezzini
キーワード
Twistronic stack
,
Bernal-stacked bilayer graphene
,
chemical vapor deposition
刊行年月日
2024-12-01
更新時刻
2025-02-07 12:30:26 +0900
キーワード
Lattice thermal conductivity
(4812)
Phonon
(463)
functionally graded materials
(63)
thermoelectric
(58)
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(55)
P2_1/c (14)
(50)
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(42)
machine learning
(37)
2D materials
(32)
C2/c (15)
(29)
Diamond
(29)
Machine learning
(26)
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(25)
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(23)
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(21)
Ga2O3
(21)
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(21)
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(20)
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(19)
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(19)
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(19)
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(18)
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(17)
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(17)
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(17)
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(16)
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(15)
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(15)
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(14)
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(14)
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(14)
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(14)
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(13)
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(13)
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(13)
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(13)
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(13)
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(13)
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(13)
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(12)
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(12)
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(12)
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(12)
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(12)
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(11)
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(11)
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(11)
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(11)
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(11)
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(11)
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(11)
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(11)
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(11)
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(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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(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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(9)
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(9)
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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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(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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Device stability
(5)
Droplet Epitaxy
(5)
Dy2Ge2O7
(5)
ELO
(5)
Electrocatalysis
(5)
Fine Structure Splitting
(5)
HfO2
(5)
I4/m (87)
(5)
I4/mmm (139)
(5)
Josephson junctions
(5)
RDEメタデータ定義
RDE送り状
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