Keyword: Phonon

1475 records found. Displaying records 1 to 10.

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Ab-initio phonon calculation for Ba2NaReO6 / Fm-3m (225) / materials id 6798
Dataset
Collection
MDR phonon calculation database
Creator
Atsushi Togo (author) (Search by this author)
MaDIS, National Institute for Materials Science
ORCID SAMURAI
Keyword
Phonon, Ba2NaReO6, Fm-3m (225)
Date published
Updated at
2023-05-14 18:58:02 +0900

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Ab-initio phonon calculation for NaReO4 / I4_1/a (88) / materials id 5558
Dataset
Collection
MDR phonon calculation database
Creator
Atsushi Togo (author) (Search by this author)
MaDIS, National Institute for Materials Science
ORCID SAMURAI
Keyword
Phonon, NaReO4, I4_1/a (88)
Date published
Updated at
2023-05-14 18:48:20 +0900

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Ab-initio phonon calculation for K3NaRe2O9 / P6_3/mmc (194) / materials id 541393
Dataset
Collection
MDR phonon calculation database
Creator
Atsushi Togo (author) (Search by this author)
MaDIS, National Institute for Materials Science
ORCID SAMURAI
Keyword
Phonon, K3NaRe2O9, P6_3/mmc (194)
Date published
Updated at
2023-05-14 18:34:30 +0900

s41524-026-02033-w.pdf
Database and deep-learning scalability of anharmonic phonon properties by automated brute-force first-principles calculations
Journal article
Creator
Masato Ohnishi (author) (Search by this author)
;
Tianqi Deng (author) (Search by this author)
;
Pol Torres (author) (Search by this author)
;
Zhihao Xu (author) (Search by this author)
; ORCID SAMURAI ;
Haoming Zhang (author) (Search by this author)
;
Wei Nong (author) (Search by this author)
;
Masatoshi Hanai (author) (Search by this author)
;
Zeyu Wang (author) (Search by this author)
;
Michimasa Morita (author) (Search by this author)
;
Zhiting Tian (author) (Search by this author)
;
Ming Hu (author) (Search by this author)
;
Xiulin Ruan (author) (Search by this author)
;
Ryo Yoshida (author) (Search by this author)
;
Toyotaro Suzumura (author) (Search by this author)
;
Lucas Lindsay (author) (Search by this author)
;
Alan J. H. McGaughey (author) (Search by this author)
;
Tengfei Luo (author) (Search by this author)
;
Kedar Hippalgaonkar (author) (Search by this author)
;
Junichiro Shiomi (author) (Search by this author)
Keyword
Thermal conductivity, Phonon, First-principles calculation
Date published
2026-04-13
Updated at
2026-05-12 08:46:56 +0900

band_structure.png
Ab-initio phonon calculation for NaAlO2 / Pna2_1 (33) / materials id 9212
Dataset
Collection
MDR phonon calculation database
Creator
Atsushi Togo (author) (Search by this author)
MaDIS, National Institute for Materials Science
ORCID SAMURAI
Keyword
Phonon, NaAlO2, Pna2_1 (33)
Date published
Updated at
2023-05-14 18:59:27 +0900

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Ab-initio phonon calculation for NaGeSbO5 / Pna2_1 (33) / materials id 8341
Dataset
Collection
MDR phonon calculation database
Creator
Atsushi Togo (author) (Search by this author)
MaDIS, National Institute for Materials Science
ORCID SAMURAI
Keyword
Phonon, NaGeSbO5, Pna2_1 (33)
Date published
Updated at
2023-05-14 19:05:36 +0900

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Ab-initio phonon calculation for Na2Ti2O5 / Pna2_1 (33) / materials id 779729
Dataset
Collection
MDR phonon calculation database
Creator
Atsushi Togo (author) (Search by this author)
MaDIS, National Institute for Materials Science
ORCID SAMURAI
Keyword
Phonon, Na2Ti2O5, Pna2_1 (33)
Date published
Updated at
2023-05-14 19:03:19 +0900

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Ab-initio phonon calculation for KNaZrSi3H4O11 / Pna2_1 (33) / materials id 773906
Dataset
Collection
MDR phonon calculation database
Creator
Atsushi Togo (author) (Search by this author)
MaDIS, National Institute for Materials Science
ORCID SAMURAI
Keyword
Phonon, KNaZrSi3H4O11, Pna2_1 (33)
Date published
Updated at
2023-05-14 19:03:00 +0900

band_structure.png
Ab-initio phonon calculation for Na2Ge2O5 / Pna2_1 (33) / materials id 771248
Dataset
Collection
MDR phonon calculation database
Creator
Atsushi Togo (author) (Search by this author)
MaDIS, National Institute for Materials Science
ORCID SAMURAI
Keyword
Phonon, Na2Ge2O5, Pna2_1 (33)
Date published
Updated at
2023-05-14 19:02:26 +0900

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Ab-initio phonon calculation for NaZnAsO4 / P6_3 (173) / materials id 6566
Dataset
Collection
MDR phonon calculation database
Creator
Atsushi Togo (author) (Search by this author)
MaDIS, National Institute for Materials Science
ORCID SAMURAI
Keyword
Phonon, NaZnAsO4, P6_3 (173)
Date published
Updated at
2023-05-14 18:48:34 +0900

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