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Journal article(2)
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First-principles calculation (2)
Curie temperature (1)
Heusler alloys (1)
Machine-learning potential (1)
Magnetic anisotropy energy (1)
Phonon (1)
Thermal conductivity (1)
Transfer learning (1)
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Creative Commons BY Attribution 4.0 International (2)
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Keyword: First-principles calculation
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Database and deep-learning scalability of anharmonic phonon properties by automated brute-force first-principles calculations
Journal article
Creator
Masato Ohnishi
(author) (
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Masato Ohnishi
;
Tianqi Deng
(author) (
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)
Tianqi Deng
;
Pol Torres
(author) (
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)
Pol Torres
;
Zhihao Xu
(author) (
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)
Zhihao Xu
;
Terumasa Tadano
(author) (
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)
https://orcid.org/0000-0002-8132-2161
NIMS Researchers Directory SAMURAI
Terumasa Tadano
;
Haoming Zhang
(author) (
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)
Haoming Zhang
;
Wei Nong
(author) (
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)
Wei Nong
;
Masatoshi Hanai
(author) (
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)
Masatoshi Hanai
;
Zeyu Wang
(author) (
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)
Zeyu Wang
;
Michimasa Morita
(author) (
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)
Michimasa Morita
;
Zhiting Tian
(author) (
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)
Zhiting Tian
;
Ming Hu
(author) (
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)
Ming Hu
;
Xiulin Ruan
(author) (
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)
Xiulin Ruan
;
Ryo Yoshida
(author) (
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Ryo Yoshida
;
Toyotaro Suzumura
(author) (
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Toyotaro Suzumura
;
Lucas Lindsay
(author) (
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)
Lucas Lindsay
;
Alan J. H. McGaughey
(author) (
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)
Alan J. H. McGaughey
;
Tengfei Luo
(author) (
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)
Tengfei Luo
;
Kedar Hippalgaonkar
(author) (
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)
Kedar Hippalgaonkar
;
Junichiro Shiomi
(author) (
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Junichiro Shiomi
Keyword
Thermal conductivity
,
Phonon
,
First-principles calculation
Date published
2026-04-13
Updated at
2026-05-12 08:46:56 +0900
Accurate screening of functional materials with machine-learning potential and transfer-learned regressions: Heusler alloy benchmark
Journal article
Creator
Enda Xiao
(author) (
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)
https://orcid.org/0000-0002-4372-1575
(unauthenticated)
Enda Xiao
;
Terumasa Tadano
(author) (
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)
https://orcid.org/0000-0002-8132-2161
NIMS Researchers Directory SAMURAI
Terumasa Tadano
Keyword
Heusler alloys
,
Machine-learning potential
,
Transfer learning
,
First-principles calculation
,
Curie temperature
,
Magnetic anisotropy energy
Date published
2026-02-19
Updated at
2026-03-30 13:06:06 +0900
Keyword
First-principles calculation
(2)
Curie temperature
(1)
Heusler alloys
(1)
Machine-learning potential
(1)
Magnetic anisotropy energy
(1)
Phonon
(1)
Thermal conductivity
(1)
Transfer learning
(1)
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