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Article and Dataset
Collection
MDR XAFS DB(2263)
MDR HAXPES DB(37)
MDR SuperCon Datasheet(4)
PoLyInfo Knowledge Collection(3)
Resource type
Dataset(2312)
Other(2)
Journal article(1)
Software(1)
Keyword
XAFS (2263)
collection - MDR XAFS DB (2263)
SPring-8 (1794)
BL14B2 (1757)
Si(111) (1316)
Si(311) (847)
Oxide (431)
Chloride (236)
Pure metal (216)
Oxide_ate (206)
(more)
License
Creative Commons BY Attribution 4.0 International (2043)
Creative Commons BY-NC-SA Attribution-NonCommercial-ShareAlike 4.0 International (269)
http://creativecommons.org/publicdomain/zero/1.0/ (1)
http://opensource.org/licenses/MIT (1)
File type
application/octet-stream (2316)
application/json (2304)
image/png (2302)
text/tab-separated-values (2302)
text/plain (1961)
application/xml (1582)
application/zip (40)
text/csv (39)
application/pdf (5)
application/vnd.openxmlformats-officedocument.spreadsheetml.sheet (2)
Chemical composition
Indium (20)
Platinum (18)
SUS316L (18)
Palladium (16)
Gold (13)
Copper (13)
Barium tungstate (11)
Nickel(II) oxide (11)
Strontium-doped Lanthanum Cobalt(III) oxide (11)
Palladium(II) oxide (10)
Analysis field
spectroscopy (2263)
Measurement method
x-ray absorption spectroscopy (2263)
scanning transmission electron microscopy (1)
Material type
Oxide (418)
Chloride (236)
Pure metal (212)
Transition metal alloy (107)
Sulfide (94)
Bromide (86)
Fluoride (85)
Sulfate (78)
Metalloid alloy (74)
Nitrate (72)
Structural feature for specimen
local structure (2263)
File type: application/octet-stream
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2316 records found.
First‑Principles Optical Dielectric Properties of NiAl (Space Group 221)
Dataset
Creator
Thien Duc Ngo
(author) (
Search by this author
)
https://orcid.org/0000-0001-5123-9001
Research Center for Materials Nanoarchitectonics, National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Thien Duc Ngo
;
Hai Dang Tran
(author) (
Search by this author
)
Research Center for Materials Nanoarchitectonics, National Institute for Materials Science
Hai Dang Tran
;
Toan Phuoc Tran
(author) (
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)
Research Center for Materials Nanoarchitectonics, National Institute for Materials Science
Toan Phuoc Tran
;
Hiroshi Harada
(author) (
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)
National Institute for Materials Science
Hiroshi Harada
;
Tadaaki Nagao
(author) (
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)
https://orcid.org/0000-0002-6746-2686
Research Center for Materials Nanoarchitectonics, National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Tadaaki Nagao
Keyword
high-temperature superalloys
,
intermetallics
,
nickel–aluminum
,
thermal emitters
,
thermophotonics
Date published
2025-03-11
Updated at
2026-06-12 08:30:20 +0900
Simple implementation examples of agent AI on free energy calculation and phase-field simulation
Journal article
Creator
Toshiyuki Koyama
(author) (
Search by this author
)
https://orcid.org/0000-0001-7424-4858
(unauthenticated)
Toshiyuki Koyama
;
Yusuke Matsuoka
(author) (
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)
https://orcid.org/0000-0001-5300-1726
NIMS Researchers Directory SAMURAI
Yusuke Matsuoka
;
Akimitsu Ishii
(author) (
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)
https://orcid.org/0000-0002-9261-4047
NIMS Researchers Directory SAMURAI
Akimitsu Ishii
Keyword
generative AI
,
LLM
,
LangGraph
,
Gibbs energy
,
Phase-field method
,
Jarzynski equality
Date published
2026-12-31
Updated at
2026-02-08 08:30:08 +0900
Benchmark Dataset used in the paper "Fast Evaluation of Unbiased Atomic Forces in ab initio Variational Monte Carlo via the Lagrangian Technique"
Dataset
Creator
Kosuke Nakano
(author) (
Search by this author
)
https://orcid.org/0000-0001-7756-4355
Center for Basic Research on Materials (CBRM), National Institute for Materials Science (NIMS)
NIMS Researchers Directory SAMURAI
Kosuke Nakano
;
Stefano Battaglia
(author) (
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)
Department of Chemistry, University of Zurich (UZH)
Stefano Battaglia
;
Jürg Hutter
(author) (
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)
Department of Chemistry, University of Zurich (UZH)
Jürg Hutter
Keyword
Variational Monte Carlo
,
Atomic forces
,
rMD17
Date published
Updated at
2026-01-28 08:30:04 +0900
PoLyInfo Ontology Version 1.2
Dataset
Collection
PoLyInfo Knowledge Collection
Creator
Masashi Ishii
(author) (
Search by this author
)
https://orcid.org/0000-0003-0357-2832
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Masashi Ishii
;
Koichi Sakamoto
(author) (
Search by this author
)
National Institute for Materials Science
Koichi Sakamoto
Keyword
Polymer chemistry knowledge
,
PoLyInfo
,
Ontology
,
BFO
,
collection - PoLyInfo Knowledge
Date published
Updated at
2025-05-03 08:30:23 +0900
PoLyInfo Ontology Version 1.1
Dataset
Collection
PoLyInfo Knowledge Collection
Creator
Masashi Ishii
(author) (
Search by this author
)
https://orcid.org/0000-0003-0357-2832
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Masashi Ishii
;
Koichi Sakamoto
(author) (
Search by this author
)
National Institute for Materials Science
Koichi Sakamoto
Keyword
Polymer chemistry knowledge
,
PoLyInfo
,
Ontology
,
BFO
,
collection - PoLyInfo Knowledge
Date published
Updated at
2025-05-03 08:30:14 +0900
Optical constants of MgxZn1-xO
Dataset
Creator
Yusuke Kozuka
(author) (
Search by this author
)
https://orcid.org/0000-0001-7674-600X
Research Center for Materials Nanoarchitectonics, National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Yusuke Kozuka
Keyword
Optical constants
,
Spectroscopic ellipsometry
,
Zinc oxide
Date published
2025-04-06
Updated at
2025-04-08 11:27:45 +0900
MDR SuperCon Datasheet Ver.240322
Dataset
Collection
MDR SuperCon Datasheet
Creator
Center for Basic Research on Materials
(editor) (
Search by this author
)
National Institute for Materials Science
Center for Basic Research on Materials
Keyword
SuperCon
,
Superconductors
,
Oxide
,
Metallic
,
Organic
,
Tc
Date published
Updated at
2024-05-14 16:30:16 +0900
MDR SuperCon Datasheet Readme Ver.2.0
Other
Collection
MDR SuperCon Datasheet
Creator
Masashi Ishii
(editor) (
Search by this author
)
https://orcid.org/0000-0003-0357-2832
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Masashi Ishii
Keyword
SuperCon
,
Superconductors
,
Oxide
,
Metallic
,
Organic
,
Readme
Date published
Updated at
2024-05-14 16:30:22 +0900
PoLyInfo Ontology Version 1.0
Dataset
Collection
PoLyInfo Knowledge Collection
Creator
Masashi Ishii
(author) (
Search by this author
)
https://orcid.org/0000-0003-0357-2832
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Masashi Ishii
;
Koichi Sakamoto
(author) (
Search by this author
)
National Institute for Materials Science
Koichi Sakamoto
Keyword
Polymer chemistry knowledge
,
PoLyInfo
,
Ontology
,
BFO
,
collection - PoLyInfo Knowledge
Date published
Updated at
2024-03-26 10:19:11 +0900
XAFS spectrum of Nickel(II) oxide
Dataset
Collection
MDR XAFS DB
Creator
Masashi Ishii
(editor) (
Search by this author
)
https://orcid.org/0000-0003-0357-2832
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Masashi Ishii
;
SAGA-LS
(author) (
Search by this author
)
Kyushu Synchrotron Light Research Center
SAGA-LS
Keyword
Nickel(II) oxide
,
NiO
,
Ni L-edge
,
Oxide
,
BL12
,
SAGA-LS
,
XAFS
,
collection - MDR XAFS DB
Date published
Updated at
2025-05-02 22:00:17 +0900
Keyword
XAFS
(2263)
collection - MDR XAFS DB
(2263)
SPring-8
(1794)
BL14B2
(1757)
Si(111)
(1316)
Si(311)
(847)
Oxide
(431)
Chloride
(236)
Pure metal
(216)
Oxide_ate
(206)
Hokkaido University, Institute for Catalysis
(199)
Alloy
(189)
Photon Factory
(136)
Ni K-edge
(109)
Transition metal alloy
(107)
Co K-edge
(98)
Fe K-edge
(98)
Sulfide
(94)
W L21-edge
(92)
Cu K-edge
(89)
Bromide
(86)
Fluoride
(85)
Sulfate
(78)
Zn K-edge
(76)
Ritsumeikan-SR
(75)
Metalloid alloy
(74)
Aichi SR
(72)
Nitrate
(72)
Ag K-edge
(67)
BL5S1
(64)
Tungstate
(64)
Ba L21-edge
(60)
In K-edge
(60)
Pb L21-edge
(60)
Pd K-edge
(59)
Mo K-edge
(58)
Zr K-edge
(58)
BL-9C
(57)
Hydroxide
(55)
Sn K-edge
(55)
Iodide
(52)
Mn K-edge
(52)
Nb K-edge
(52)
BL-10
(51)
W L3-edge
(51)
Boride
(47)
Nitride
(46)
Cr K-edge
(45)
Ta L21-edge
(44)
Ti K-edge
(43)
Organometal
(42)
Silicide
(41)
La L21-edge
(40)
Carbonate
(39)
Carbide
(38)
BL46XU
(37)
HAXPES
(37)
collection - MDR HAXPES DB
(37)
Acetate
(34)
Oxalate
(34)
Pt L3-edge
(34)
Titanate
(34)
Molybdate
(33)
Ru K-edge
(33)
BL-12C
(32)
Pb L3-edge
(32)
Sb K-edge
(32)
Ba K-edge
(31)
Ba L3-edge
(31)
AR-NW10A
(30)
Er L21-edge
(28)
Hydride
(28)
Ir L21-edge
(28)
Ce L21-edge
(26)
Phosphate
(26)
Au L3-edge
(24)
Cs L21-edge
(24)
Rh K-edge
(24)
SAGA-LS
(24)
Ta L3-edge
(24)
W K-edge
(23)
In
(20)
Indium
(20)
Ir L3-edge
(20)
La K-edge
(20)
La L3-edge
(20)
Yb L21-edge
(20)
Zirconate
(20)
Pt L2-edge
(19)
V K-edge
(19)
Acetylacetonate
(18)
Ce K-edge
(18)
Eu L21-edge
(18)
Platinum
(18)
Pt
(18)
SUS316L
(18)
Au L1-edge
(17)
Au L2-edge
(17)
BL-9A
(17)
Pd
(17)
Phosphorate
(17)
Pt L1-edge
(17)
Palladium
(16)
Tb L21-edge
(16)
S K-edge
(15)
Tungsten carbide
(15)
Au
(14)
Ce L3-edge
(14)
Cu
(14)
Er L3-edge
(14)
Tantalum boride
(14)
Tantalum nitride
(14)
Chlorate
(13)
Copper
(13)
Cs L3-edge
(13)
Gold
(13)
Cs K-edge
(12)
Titanium(IV) oxide
(12)
(La,Sr)CoO3
(11)
BaWO4
(11)
Barium tungstate
(11)
Ca K-edge
(11)
Metal acid
(11)
NiO
(11)
Nickel(II) oxide
(11)
Niobate
(11)
Phosphide
(11)
Strontium-doped Lanthanum Cobalt(III) oxide
(11)
Ta K-edge
(11)
Al K-edge
(10)
BL-11
(10)
Eu L3-edge
(10)
Fe
(10)
Ir
(10)
Palladium(II) oxide
(10)
PdO
(10)
Phthalocyanine
(10)
Si K-edge
(10)
Yb L3-edge
(10)
Zn
(10)
Ag2WO4
(9)
BL12
(9)
Chromate
(9)
Co
(9)
CoWO4
(9)
Cobalt
(9)
Cobalt tungstate
(9)
Copper tungstate
(9)
Copper(II) oxide
(9)
CuO
(9)
CuWO4
(9)
Eu K-edge
(9)
Hexafluoride
(9)
IrO2
(9)
Iridium
(9)
Iridium(IV) oxide
(9)
Iron
(9)
La0.6Sr0.4CoO3
(9)
Mn
(9)
Mo
(9)
Nd K-edge
(9)
Nd L1-edge
(9)
Nd L2-edge
(9)
Nd L3-edge
(9)
NiWO4
(9)
Nickel tungstate
(9)
Platinum(IV) oxide
(9)
PtO2
(9)
Silicate
(9)
Silver(I) tungstate
(9)
Ta
(9)
TiO2(rutile)
(9)
Titanium(IV) dioxide (Rutile)
(9)
Vanadate
(9)
W
(9)
Zinc
(9)
Zinc tungstate
(9)
ZnWO4
(9)
Zr
(9)
Ag L3-edge
(8)
AgPd
(8)
BL10
(8)
BL11S2
(8)
CeO2
(8)
Cerium(IV) oxide
(8)
Co3O4
(8)
CoO
(8)
Cobalt(II) oxide
(8)
Cobalt(II,III) oxide
(8)
F K-edge
(8)
FeWO4
(8)
Ge(111)
(8)
Iron tungstate
(8)
Lanthanoid alloy
(8)
Lead zirconate
(8)
Manganese
(8)
Molybdenum
(8)
Ni
(8)
Nickel
(8)
Palladium-silver alloy
(8)
RDE metadata def
RDE invoice schema
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