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論文・データセット
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データセット(5)
ジャーナル論文(2)
キーワード
Heusler alloys (2)
Ab initio Quantum Monte Carlo (1)
Atomic forces (1)
BERT (1)
Band structure (1)
DFT (1)
Density functional theory (1)
Equation of State (1)
High-throughput calculations (1)
Hydrogen (1)
(more)
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Creative Commons BY Attribution 4.0 International (4)
Creative Commons BY-ND Attribution-NoDerivatives 4.0 International (1)
http://creativecommons.org/publicdomain/zero/1.0/ (1)
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text/markdown (7)
application/zip (4)
text/plain (4)
application/pdf (2)
application/x-xz (2)
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ファイル種別: text/markdown
全ての絞り込みを解除
7 件のレコードが見つかりました。
Benchmark Dataset used in the paper "Fast Evaluation of Unbiased Atomic Forces in ab initio Variational Monte Carlo via the Lagrangian Technique"
データセット
著者
Kosuke Nakano
(author) (
この著者で検索
)
https://orcid.org/0000-0001-7756-4355
National Institute for Materials Science (NIMS) Center for Basic Research on Materials (CBRM)
NIMS Researchers Directory SAMURAI
Kosuke Nakano
;
Stefano Battaglia
(author) (
この著者で検索
)
University of Zurich (UZH) Department of Chemistry
Stefano Battaglia
;
Jürg Hutter
(author) (
この著者で検索
)
University of Zurich (UZH) Department of Chemistry
Jürg Hutter
キーワード
Variational Monte Carlo
,
Atomic forces
,
rMD17
刊行年月日
更新時刻
2026-01-28 08:30:04 +0900
Hydrogen Equation of State with SCAN-VV10
データセット
著者
Cesare Cozza
(author) (
この著者で検索
)
University of Zurich Department of Astrophysics
Cesare Cozza
;
Kousuke Nakano
(author) (
この著者で検索
)
https://orcid.org/0000-0001-7756-4355
National Institute for Materials Science (NIMS) Center for Basic Research on Materials
NIMS Researchers Directory SAMURAI
Kousuke Nakano
;
Saburo Howard
(author) (
この著者で検索
)
University of Zurich Department of Astrophysics
Saburo Howard
;
Hao Xie
(author) (
この著者で検索
)
University of Zurich Department of Astrophysics
Hao Xie
;
Ravit Helled
(author) (
この著者で検索
)
University of Zurich Department of Astrophysics
Ravit Helled
;
Guglielmo Mazzola
(author) (
この著者で検索
)
University of Zurich Department of Astrophysics
Guglielmo Mazzola
キーワード
Hydrogen
,
Equation of State
,
DFT
,
SCAN-VV10
刊行年月日
更新時刻
2026-01-20 08:34:18 +0900
HeuslerDB_elecBand_ver1.0
データセット
著者
Terumasa Tadano
(author) (
この著者で検索
)
https://orcid.org/0000-0002-8132-2161
National Institute for Materials Science Spin Theory Group, Research Center for Magnetic and Spintronic Materials
NIMS Researchers Directory SAMURAI
Terumasa Tadano
キーワード
Heusler alloys
,
Density functional theory
,
Band structure
刊行年月日
2025-07-16
更新時刻
2025-10-06 16:30:11 +0900
HeuslerDB_elecDOS_ver1.0
データセット
著者
Terumasa Tadano
(author) (
この著者で検索
)
https://orcid.org/0000-0002-8132-2161
National Institute for Materials Science Spin Theory Group, Research Center for Magnetic and Spintronic Materials
NIMS Researchers Directory SAMURAI
Terumasa Tadano
キーワード
Heusler alloys
刊行年月日
2025-07-16
更新時刻
2025-10-06 16:30:20 +0900
Python suites for high-throughput calculations of the ab-initio quantum Monte Carlo methods
データセット
著者
NAKANO, Kosuke
(author) (
この著者で検索
)
https://orcid.org/0000-0001-7756-4355
National Institute for Materials Science (NIMS) Center for Basic Research on Materials
NIMS Researchers Directory SAMURAI
NAKANO, Kosuke
;
Oto Kohulák
(author) (
この著者で検索
)
International School for Advanced Studies (SISSA)
Oto Kohulák
;
Abhishek Raghav
(author) (
この著者で検索
)
International School for Advanced Studies (SISSA)
Abhishek Raghav
;
Michele Casula
(author) (
この著者で検索
)
Sorbonne Université Institut de Minéralogie, de Physique des Matériaux et de Cosmochimie (IMPMC)
Michele Casula
;
Sandro Sorella
(author) (
この著者で検索
)
International School for Advanced Studies (SISSA)
Sandro Sorella
キーワード
Ab initio Quantum Monte Carlo
,
High-throughput calculations
,
TurboRVB
,
TurboGenius
刊行年月日
更新時刻
2023-11-15 15:38:36 +0900
MaterialBERT for Natural Language Processing of Materials Science Texts
ジャーナル論文
著者
KAWANO, Hiroyuki
(author) (
この著者で検索
)
Ridgelinez Limited
KAWANO, Hiroyuki
;
SATO, Fumitaka
(author) (
この著者で検索
)
Ridgelinez Limited
SATO, Fumitaka
;
YOSHITAKE, Michiko
(author) (
この著者で検索
)
https://orcid.org/0000-0002-0973-5666
National Institute for Materials Science MaDIS
NIMS Researchers Directory SAMURAI
YOSHITAKE, Michiko
;
MOTEKI, Fuma
(operator) (
この著者で検索
)
Ridgelinez Limited
MOTEKI, Fuma
;
TERAOKA, Hiroshi
(author) (
この著者で検索
)
Ridgelinez Limited
TERAOKA, Hiroshi
キーワード
word embedding
,
pre-training
,
BERT
,
literal information
刊行年月日
更新時刻
2025-04-15 08:30:11 +0900
Automatic Threshold Prediction of Photoelectron Yield Spectroscopy (PYS) by Machine Learning
ジャーナル論文
著者
YAGYU, Shinjiro
(author) (
この著者で検索
)
https://orcid.org/0000-0002-9825-5719
NIMS Researchers Directory SAMURAI
YAGYU, Shinjiro
;
YOSHITAKE, Michiko
(author) (
この著者で検索
)
YOSHITAKE, Michiko
;
CHIKYOW, Toyohiro
(author) (
この著者で検索
)
https://orcid.org/0000-0003-3860-4806
NIMS Researchers Directory SAMURAI
CHIKYOW, Toyohiro
;
NAGATA, Takahiro
(author) (
この著者で検索
)
https://orcid.org/0000-0002-8591-2943
NIMS Researchers Directory SAMURAI
NAGATA, Takahiro
キーワード
threshold
,
machine learning
,
photoelectron yield spectroscopy
刊行年月日
2020-06-10
更新時刻
2024-01-05 22:12:44 +0900
キーワード
Heusler alloys
(2)
Ab initio Quantum Monte Carlo
(1)
Atomic forces
(1)
BERT
(1)
Band structure
(1)
DFT
(1)
Density functional theory
(1)
Equation of State
(1)
High-throughput calculations
(1)
Hydrogen
(1)
SCAN-VV10
(1)
TurboGenius
(1)
TurboRVB
(1)
Variational Monte Carlo
(1)
literal information
(1)
machine learning
(1)
photoelectron yield spectroscopy
(1)
pre-training
(1)
rMD17
(1)
threshold
(1)
word embedding
(1)
RDEメタデータ定義
RDE送り状
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1
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