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Article and Dataset
Collection
MDR lattice thermal conductivity calculation database(4811)
MDR phonon calculation database(20)
MDR XAFS DB(2)
Resource type
Dataset(4834)
Journal article(35)
Conference presentation(1)
Keyword
Lattice thermal conductivity (4811)
Phonon (20)
BiOF (7)
ZrO2 (6)
Al(HO)3 (5)
Al2O3 (5)
AlHO2 (5)
HfO2 (5)
Na2Si2O5 (5)
SiO2 (5)
(more)
License
Creative Commons BY Attribution 4.0 International (4848)
Creative Commons BY-NC-ND Attribution-NonCommercial-NoDerivs 4.0 International (7)
Creative Commons BY-NC Attribution-NonCommercial 4.0 International (5)
In Copyright (5)
cc-by-nc-3.0 (2)
cc-by-3.0 (1)
Creative Commons BY-NC-SA Attribution-NonCommercial-ShareAlike 4.0 International (1)
https://creativecommons.org/licenses/by/3.0/ (1)
File type
image/png (4833)
application/x-xz (4831)
text/x-log (4811)
application/pdf (32)
application/vnd.openxmlformats-officedocument.wordprocessingml.document (4)
application/zip (3)
application/json (2)
application/octet-stream (2)
text/tab-separated-values (2)
application/vnd.openxmlformats-officedocument.spreadsheetml.sheet (1)
Chemical composition
HOPG, Highly oriented pyrolytic graphite (2)
Analysis field
spectroscopy (2)
Measurement method
x-ray absorption spectroscopy (2)
Material type
Pure nonmetal (2)
Structural feature for specimen
local structure (2)
Instrument name
BL-11_XAFS (1)
BL12_XAFS (1)
4870 records found. Displaying records 41 to 50.
First-principles lattice thermal conductivity calculation for DyTaO4 / P2/c (13) / materials id 7703
Dataset
Collection
MDR lattice thermal conductivity calculation database
Creator
Atsushi Togo
(author) (
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)
https://orcid.org/0000-0001-8393-9766
Center for Basic Research on Materials, National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Atsushi Togo
Keyword
Lattice thermal conductivity
,
DyTaO4
Date published
Updated at
2026-01-24 14:19:35 +0900
First-principles lattice thermal conductivity calculation for DyTaO4 / C2/c (15) / materials id 557914
Dataset
Collection
MDR lattice thermal conductivity calculation database
Creator
Atsushi Togo
(author) (
Search by this author
)
https://orcid.org/0000-0001-8393-9766
Center for Basic Research on Materials, National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Atsushi Togo
Keyword
Lattice thermal conductivity
,
DyTaO4
Date published
Updated at
2026-01-15 15:00:58 +0900
First-principles lattice thermal conductivity calculation for DyTlS2 / R-3m (166) / materials id 31166
Dataset
Collection
MDR lattice thermal conductivity calculation database
Creator
Atsushi Togo
(author) (
Search by this author
)
https://orcid.org/0000-0001-8393-9766
Center for Basic Research on Materials, National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Atsushi Togo
Keyword
Lattice thermal conductivity
,
DyTlS2
Date published
Updated at
2026-01-24 13:23:48 +0900
Monitoring Electrochemical Dynamics through Single-Molecule Imaging of hBN Surface Emitters in Organic Solvents
Journal article
Creator
Eveline Mayner
(author) (
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)
Eveline Mayner
;
Nathan Ronceray
(author) (
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)
Nathan Ronceray
;
Martina Lihter
(author) (
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)
Martina Lihter
;
Tzu-Heng Chen
(author) (
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)
Tzu-Heng Chen
;
Kenji Watanabe
(author) (
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)
https://orcid.org/0000-0003-3701-8119
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Kenji Watanabe
;
Takashi Taniguchi
(author) (
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)
https://orcid.org/0000-0002-1467-3105
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Takashi Taniguchi
;
Aleksandra Radenovic
(author) (
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)
Aleksandra Radenovic
Keyword
single-molecule imaging
,
electrochemical dynamics
,
hexagonal boron nitride (hBN)
Date published
2024-10-08
Updated at
2026-02-16 18:39:12 +0900
NIMS-OS: An automation software to implement a closed loop between artificial intelligence and robotic experiments in materials science
Journal article
Creator
Ryo Tamura
(author) (
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)
https://orcid.org/0000-0002-0349-358X
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Ryo Tamura
;
Koji Tsuda
(author) (
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)
https://orcid.org/0000-0002-4288-1606
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Koji Tsuda
;
Shoichi Matsuda
(author) (
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)
https://orcid.org/0000-0002-0640-3404
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Shoichi Matsuda
Keyword
NIMS-OS
,
artificial intelligence
,
robotic experiments
Date published
2023-12-31
Updated at
2024-01-05 22:12:12 +0900
Dataset of La(Fe,Si)13-based magnetocaloric alloys
Dataset
Creator
Anton Bolyachkin
(author) (
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)
Research Center for Magnetic and Spintronic Materials, National Institute for Materials Science
Anton Bolyachkin
;
Srinithi Ashok Krishnaswamy
(author) (
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)
Research Center for Magnetic and Spintronic Materials, National Institute for Materials Science
Srinithi Ashok Krishnaswamy
Keyword
La(Fe,Si)13
,
Magnetocaloric effect
,
Transition temperature
,
Entropy change
,
Thermal hysteresis
Date published
Updated at
2024-12-02 16:30:26 +0900
Near-surface defects break symmetry in water adsorption on CeO2−x(111)
Journal article
Creator
Oscar Custance
(author) (
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)
https://orcid.org/0000-0001-7931-603X
NIMS Researchers Directory SAMURAI
Oscar Custance
;
Manuel González Lastre
(author) (
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)
https://orcid.org/0009-0000-2299-6687
(unauthenticated)
Manuel González Lastre
;
Kyungmin Kim
(author) (
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)
https://orcid.org/0000-0002-3147-5100
(unauthenticated)
Kyungmin Kim
;
Estefanía Fernández-Villanueva
(author) (
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)
https://orcid.org/0000-0002-9419-0786
(unauthenticated)
Estefanía Fernández-Villanueva
;
Pablo Pou
(author) (
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)
https://orcid.org/0000-0002-5854-8218
(unauthenticated)
Pablo Pou
;
Masayuki Abe
(author) (
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)
https://orcid.org/0000-0001-5619-3911
(unauthenticated)
Masayuki Abe
;
Hossein Sepehri-Amin
(author) (
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)
https://orcid.org/0000-0002-7856-7897
NIMS Researchers Directory SAMURAI
Hossein Sepehri-Amin
;
Shigeki Kawai
(author) (
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)
https://orcid.org/0000-0003-2128-0120
NIMS Researchers Directory SAMURAI
Shigeki Kawai
;
M. Verónica Ganduglia-Pirovano
(author) (
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)
https://orcid.org/0000-0003-2408-8898
(unauthenticated)
M. Verónica Ganduglia-Pirovano
;
Ruben Perez
(author) (
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)
https://orcid.org/0000-0001-5896-541X
(unauthenticated)
Ruben Perez
Keyword
scanning probe microscopy
,
cerium dioxide
,
water
,
surface
,
thin films
,
density functional theory
Date published
2026-01-23
Updated at
2026-02-08 08:30:20 +0900
Thermally polymerizable phthalocyanine realizes a metal–nitrogen-doped carbon material featuring a defined single-atom catalyst motif with CO
2
RR activity
Journal article
Creator
Yuki Sano
(author) (
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)
Yuki Sano
;
Daichi Nakajima
(author) (
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)
Daichi Nakajima
;
Biplab Manna
(author) (
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)
https://orcid.org/0000-0002-7619-7765
NIMS Researchers Directory SAMURAI
Biplab Manna
;
Koki Chida
(author) (
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)
https://orcid.org/0000-0003-1197-8592
(unauthenticated)
Koki Chida
;
Ryojun Toyoda
(author) (
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)
https://orcid.org/0000-0002-0168-0533
(unauthenticated)
Ryojun Toyoda
;
Shinya Takaishi
(author) (
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)
https://orcid.org/0000-0002-6739-8119
(unauthenticated)
Shinya Takaishi
;
Kazuyuki Iwase
(author) (
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)
https://orcid.org/0000-0002-5196-741X
(unauthenticated)
Kazuyuki Iwase
;
Koji Harano
(author) (
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)
https://orcid.org/0000-0001-6800-8023
NIMS Researchers Directory SAMURAI
Koji Harano
;
Yuta Nishina
(author) (
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)
https://orcid.org/0000-0002-4958-1753
(unauthenticated)
Yuta Nishina
;
Takeharu Yoshii
(author) (
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)
https://orcid.org/0000-0002-1869-6021
(unauthenticated)
Takeharu Yoshii
;
Ryota Sakamoto
(author) (
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)
https://orcid.org/0000-0002-8702-1378
(unauthenticated)
Ryota Sakamoto
Keyword
phthalocyanine
,
catalyst
,
CO2 reduction
,
transmission electron microscopy
Date published
2025-08-26
Updated at
2025-09-10 16:30:30 +0900
CrySPY: a crystal structure prediction tool accelerated by machine learning
Journal article
Creator
Tomoki Yamashita
(author) (
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)
Tomoki Yamashita
;
Shinichi Kanehira
(author) (
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)
Shinichi Kanehira
;
Nobuya Sato
(author) (
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)
Nobuya Sato
;
Hiori Kino
(author) (
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)
https://orcid.org/0000-0002-8912-686X
National Institute for Materials Science
Hiori Kino
;
Kei Terayama
(author) (
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)
Kei Terayama
;
Hikaru Sawahata
(author) (
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)
Hikaru Sawahata
;
Takumi Sato
(author) (
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)
Takumi Sato
;
Futoshi Utsuno
(author) (
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)
Futoshi Utsuno
;
Koji Tsuda
(author) (
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)
https://orcid.org/0000-0002-4288-1606
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Koji Tsuda
;
Takashi Miyake
(author) (
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)
https://orcid.org/0000-0003-2658-3470
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Takashi Miyake
;
Tamio Oguchi
(author) (
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)
Tamio Oguchi
Keyword
crystal structure prediction
,
Bayesian optimization
,
LAQA
,
first-principles calculations
,
evolutionary algorithm
Date published
2021-01-01
Updated at
2024-04-02 23:51:18 +0900
Structural and electronic properties of transferred graphene on yttrium iron garnet (111)
Journal article
Creator
Thang Dinh Phan
(author) (
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)
https://orcid.org/0000-0002-2446-0453
NIMS Researchers Directory SAMURAI
Thang Dinh Phan
;
Shunsuke Tsuda
(author) (
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)
https://orcid.org/0000-0001-6209-8048
NIMS Researchers Directory SAMURAI
Shunsuke Tsuda
;
Riku Goto
(author) (
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)
Riku Goto
;
Naoka Nagamura
(author) (
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)
https://orcid.org/0000-0002-7697-8983
NIMS Researchers Directory SAMURAI
Naoka Nagamura
;
Ovidiu Cretu
(author) (
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)
https://orcid.org/0000-0002-1822-8172
NIMS Researchers Directory SAMURAI
Ovidiu Cretu
;
Koji Kimoto
(author) (
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)
https://orcid.org/0000-0002-3927-0492
NIMS Researchers Directory SAMURAI
Koji Kimoto
;
Koichiro Yaji
(author) (
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)
https://orcid.org/0000-0002-0721-1316
NIMS Researchers Directory SAMURAI
Koichiro Yaji
Keyword
graphene
,
electronic state
,
angle-resolved photoemission spectroscopy
Date published
2025-08-14
Updated at
2025-08-26 08:30:16 +0900
Keyword
Lattice thermal conductivity
(4811)
Phonon
(20)
BiOF
(7)
ZrO2
(6)
Al(HO)3
(5)
Al2O3
(5)
AlHO2
(5)
HfO2
(5)
Na2Si2O5
(5)
SiO2
(5)
TiO2
(5)
AgI
(4)
Ba(HO)2
(4)
Cd(InSe2)2
(4)
CdI2
(4)
DyTaO4
(4)
Ho2S3
(4)
MgH2
(4)
MgSiO3
(4)
Na3CuO2
(4)
Rb2O
(4)
Y2Si2O7
(4)
YTaO4
(4)
Ba2Sc2O5
(3)
Ba2SrI6
(3)
BaCl2
(3)
BaLa2O4
(3)
Ca3(AlN2)2
(3)
Ca3N2
(3)
Ca4Ta2O9
(3)
CdP2
(3)
CuI
(3)
Dy2S3
(3)
K2LiAlF6
(3)
K2O
(3)
K2PbO3
(3)
KHO
(3)
KSbO3
(3)
La2O3
(3)
Li3CuS2
(3)
LiAgF4
(3)
LiBeH3
(3)
LiI
(3)
LiSbO3
(3)
LiYF4
(3)
Lu2GeO5
(3)
MgAl2O4
(3)
MgGeO3
(3)
Na2SnO3
(3)
Na2UO4
(3)
NaLaO2
(3)
NaLuO2
(3)
NaTmO2
(3)
NdTaO4
(3)
PbI2
(3)
Pnma (62)
(3)
R-3m (166)
(3)
Rb2GeF6
(3)
Rh2O3
(3)
ScHO2
(3)
SmAsO4
(3)
SmTaO4
(3)
SnO2
(3)
Sr2CaI6
(3)
SrCa2I6
(3)
SrLu2O4
(3)
SrSc2O4
(3)
Tm2GeO5
(3)
Tm2S3
(3)
Y2HfO5
(3)
YTa3O9
(3)
ZnP2
(3)
ZnS
(3)
Zr3N4
(3)
solid electrolytes
(3)
Ac2S3
(2)
AgBr
(2)
AgCl
(2)
Al2CdSe4
(2)
Al2SiO5
(2)
Al5C3N
(2)
AlAs
(2)
AlBPbO4
(2)
AlCuO2
(2)
AlF3
(2)
AlN
(2)
AlP
(2)
Ar
(2)
Ba(AlTe2)2
(2)
Ba(DyTe2)2
(2)
Ba(H2O3)2
(2)
Ba(YTe2)2
(2)
Ba2GeO4
(2)
Ba2LaCl7
(2)
Ba2Si3O8
(2)
Ba2Ti6N2O11
(2)
Ba2YTaO6
(2)
Ba3(SnP2)2
(2)
Ba4Sn3O10
(2)
BaBe2Si2O7
(2)
BaCO3
(2)
BaCa2I6
(2)
BaF2
(2)
BaI2
(2)
BaLiP
(2)
BaLu2O4
(2)
BaTm2O4
(2)
BaYF5
(2)
BaZnCl4
(2)
BaZrF6
(2)
Be3N2
(2)
BeO
(2)
Bi3BrO4
(2)
BiAsO4
(2)
C
(2)
C K-edge
(2)
C2/c (15)
(2)
Ca(BO2)2
(2)
Ca(GaO2)2
(2)
Ca2SiO4
(2)
Ca2SnS4
(2)
Ca3Ta2O8
(2)
CaAl2O4
(2)
CaAlF5
(2)
CaC2
(2)
CaCl2
(2)
CaPbI4
(2)
CaSO4
(2)
CaSeO3
(2)
CaSnO3
(2)
CaTiO3
(2)
Cd(HO)2
(2)
Cd2P3Cl
(2)
CdBr2
(2)
CdGe(BiO3)2
(2)
CdGeO3
(2)
CdS
(2)
CdSe
(2)
CdSeO4
(2)
CdSnO3
(2)
CdTe
(2)
CoAsS
(2)
Cs2MgH4
(2)
Cs2PtF6
(2)
CsAlF4
(2)
CsBr
(2)
CsCl
(2)
CsDyS2
(2)
CsMgH3
(2)
CsPrS2
(2)
CsSn
(2)
Cu3SbS3
(2)
CuBr
(2)
CuCl
(2)
Dy2O3
(2)
Dy2SO2
(2)
Dy2SiO5
(2)
DyGaO3
(2)
DyHO2
(2)
DyTiClO3
(2)
DyTlS2
(2)
DyTlSe2
(2)
Er2S3
(2)
Er2Si2O7
(2)
Er2SiO5
(2)
Er2TeO2
(2)
ErNbO4
(2)
ErTaO4
(2)
FeP4
(2)
FeS2
(2)
Ga2O3
(2)
GaCuO2
(2)
GaHO2
(2)
GaN
(2)
GaP
(2)
GaSe
(2)
GaTe
(2)
GeO2
(2)
H4BrN
(2)
HOPG, Highly oriented pyrolytic graphite
(2)
Hf2P2O9
(2)
Hf3N2O3
(2)
Hf3N4
(2)
HfZrO4
(2)
Hg3(ClO)2
(2)
HgS
(2)
HgSeO3
(2)
Ho2SO2
(2)
HoBO3
(2)
HoGaO3
(2)
HoHO2
(2)
HoTaO4
(2)
In2O3
(2)
In3SnI5
(2)
InP
(2)
InPO4
(2)
InS
(2)
K2GeF6
(2)
K2LiAlH6
(2)
K2Mg2O3
(2)
RDE metadata def
RDE invoice schema
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Filter
Collection
MDR lattice thermal conductivity calculation database(4811)
MDR phonon calculation database(20)
MDR XAFS DB(2)
Resource type
Dataset(4834)
Journal article(35)
Conference presentation(1)
Keyword
Lattice thermal conductivity (4811)
Phonon (20)
BiOF (7)
ZrO2 (6)
Al(HO)3 (5)
Al2O3 (5)
AlHO2 (5)
HfO2 (5)
Na2Si2O5 (5)
SiO2 (5)
(more)
License
Creative Commons BY Attribution 4.0 International (4848)
Creative Commons BY-NC-ND Attribution-NonCommercial-NoDerivs 4.0 International (7)
Creative Commons BY-NC Attribution-NonCommercial 4.0 International (5)
In Copyright (5)
cc-by-nc-3.0 (2)
cc-by-3.0 (1)
Creative Commons BY-NC-SA Attribution-NonCommercial-ShareAlike 4.0 International (1)
https://creativecommons.org/licenses/by/3.0/ (1)
File type
image/png (4833)
application/x-xz (4831)
text/x-log (4811)
application/pdf (32)
application/vnd.openxmlformats-officedocument.wordprocessingml.document (4)
application/zip (3)
application/json (2)
application/octet-stream (2)
text/tab-separated-values (2)
application/vnd.openxmlformats-officedocument.spreadsheetml.sheet (1)
Chemical composition
HOPG, Highly oriented pyrolytic graphite (2)
Analysis field
spectroscopy (2)
Measurement method
x-ray absorption spectroscopy (2)
Material type
Pure nonmetal (2)
Structural feature for specimen
local structure (2)
Instrument name
BL-11_XAFS (1)
BL12_XAFS (1)