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Research Highlights(1)
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Journal article(2)
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Magazine(1)
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Density functional theory (4)
Acetylene hydrogenation (1)
Adsorption energy (1)
Band structure (1)
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Clays (1)
First-principles simulation (1)
Friction coefficients (1)
Geophysics (1)
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Creative Commons BY Attribution 4.0 International (3)
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Keyword: Density functional theory
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Combinatorial characterization of metastable luminous silver cations
Journal article
Creator
Hirokazu Masai
(author) (
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Hirokazu Masai
;
Masanori Koshimizu
(author) (
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)
Masanori Koshimizu
;
Hiroki Kawamoto
(author) (
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)
Hiroki Kawamoto
;
Hiroyuki Setoyama
(author) (
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)
Hiroyuki Setoyama
;
Yohei Onodera
(author) (
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https://orcid.org/0000-0002-3080-6991
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Yohei Onodera
;
Kazutaka Ikeda
(author) (
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Kazutaka Ikeda
;
Shingo Maruyama
(author) (
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)
Shingo Maruyama
;
Naoki Haruta
(author) (
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)
Naoki Haruta
;
Tohru Sato
(author) (
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)
Tohru Sato
;
Yuji Matsumoto
(author) (
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)
Yuji Matsumoto
;
Chika Takahashi
(author) (
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)
Chika Takahashi
;
Teruyasu Mizoguchi
(author) (
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Teruyasu Mizoguchi
Keyword
Glass
,
Radiophotoluminescence
,
X-ray diffraction
,
Neutron diffraction
,
Reverse Monte Carlo
,
Density functional theory
,
X-ray absorption fine structure
Date published
2024-02-26
Updated at
2024-03-28 12:30:33 +0900
[Research Highlights Vol.48] Origins of Macroscopic Friction Linked to Energy Landscape on the Nanoscale
Magazine
Collection
Research Highlights
Creator
International Center for Materials Nanoarchitectonics (WPI-MANA)
(author) (
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National Institute for Materials Science
International Center for Materials Nanoarchitectonics (WPI-MANA)
Keyword
Clays
,
Layered minerals
,
Mica
,
Kaolinite
,
Friction coefficients
,
Geophysics
,
Natural faults
,
Interlayer bonding
,
First-principles simulation
,
Density functional theory
,
van der Waals interaction
Date published
2019-03-19
Updated at
2023-12-25 00:30:23 +0900
Effects of elemental substitution on catalytic properties of Tsai-type 1/1 quasicrystal approximants for acetylene hydrogenation
Journal article
Creator
Haruka Yoshikawa
(author) (
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)
Haruka Yoshikawa
;
Ya Xu
(author) (
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)
https://orcid.org/0000-0001-9067-5244
National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Ya Xu
;
Farid Labib
(author) (
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)
Farid Labib
;
Satoshi Kameoka
(author) (
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)
Satoshi Kameoka
;
Ryuji Tamura
(author) (
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)
Ryuji Tamura
Keyword
Acetylene hydrogenation
,
Quasicrystal approximant
,
Hard X-ray electron spectroscopy
,
Density functional theory
,
Catalytic activity
,
Non-equivalent crystallographic site
,
Adsorption energy
Date published
2026-09-11
Updated at
2026-10-06 10:28:37 +0900
HeuslerDB_elecBand_ver1.0
Dataset
Creator
Terumasa Tadano
(author) (
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)
https://orcid.org/0000-0002-8132-2161
Spin Theory Group, Research Center for Magnetic and Spintronic Materials, National Institute for Materials Science
NIMS Researchers Directory SAMURAI
Terumasa Tadano
Keyword
Heusler alloys
,
Density functional theory
,
Band structure
Date published
2025-07-16
Updated at
2025-10-06 16:30:11 +0900
Keyword
Density functional theory
(4)
Acetylene hydrogenation
(1)
Adsorption energy
(1)
Band structure
(1)
Catalytic activity
(1)
Clays
(1)
First-principles simulation
(1)
Friction coefficients
(1)
Geophysics
(1)
Glass
(1)
Hard X-ray electron spectroscopy
(1)
Heusler alloys
(1)
Interlayer bonding
(1)
Kaolinite
(1)
Layered minerals
(1)
Mica
(1)
Natural faults
(1)
Neutron diffraction
(1)
Non-equivalent crystallographic site
(1)
Quasicrystal approximant
(1)
Radiophotoluminescence
(1)
Reverse Monte Carlo
(1)
X-ray absorption fine structure
(1)
X-ray diffraction
(1)
van der Waals interaction
(1)
RDE metadata def
RDE invoice schema
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Collection
Research Highlights(1)
Resource type
Journal article(2)
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Magazine(1)
Keyword
Density functional theory (4)
Acetylene hydrogenation (1)
Adsorption energy (1)
Band structure (1)
Catalytic activity (1)
Clays (1)
First-principles simulation (1)
Friction coefficients (1)
Geophysics (1)
Glass (1)
(more)
License
Creative Commons BY Attribution 4.0 International (3)
In Copyright (1)
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application/pdf (3)
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