MDR: NIMS Materials Data Repository

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471 件のレコードが見つかりました。 41件目から50件目まで表示します。

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Reproducibility of fixed-node diffusion Monte Carlo across diverse community codes: The case of water–methane dimer

ジャーナル論文
著者: Flaviano Della Pia (author) (この著者で検索)

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Benjamin X. Shi (author) (この著者で検索)

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Yasmine S. Al-Hamdani (author) (この著者で検索)

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Dario Alfé (author) (この著者で検索)

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Tyler A. Anderson (author) (この著者で検索)

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Matteo Barborini (author) (この著者で検索)

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Anouar Benali (author) (この著者で検索)

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Michele Casula (author) (この著者で検索)

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Neil D. Drummond (author) (この著者で検索)

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Matúš Dubecký (author) (この著者で検索)

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Claudia Filippi (author) (この著者で検索)

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Paul R. C. Kent (author) (この著者で検索)

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Jaron T. Krogel (author) (この著者で検索)

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Pablo López Ríos (author) (この著者で検索)

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Arne Lüchow (author) (この著者で検索)

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Ye Luo (author) (この著者で検索)

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Angelos Michaelides (author) (この著者で検索)

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Lubos Mitas (author) (この著者で検索)

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Kousuke Nakano (author) (この著者で検索)

https://orcid.org/0000-0001-7756-4355

National Institute for Materials Science

NIMS Researchers Directory SAMURAI

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Richard J. Needs (author) (この著者で検索)

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Manolo C. Per (author) (この著者で検索)

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Anthony Scemama (author) (この著者で検索)

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Jil Schultze (author) (この著者で検索)

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Ravindra Shinde (author) (この著者で検索)

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Emiel Slootman (author) (この著者で検索)

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Sandro Sorella (author) (この著者で検索)

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Alexandre Tkatchenko (author) (この著者で検索)

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Mike Towler (author) (この著者で検索)

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C. J. Umrigar (author) (この著者で検索)

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Lucas K. Wagner (author) (この著者で検索)

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William A. Wheeler (author) (この著者で検索)

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Haihan Zhou (author) (この著者で検索)

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Andrea Zen (author) (この著者で検索)
キーワード: Quantum Monte Carlo, Diffusion Monte Carlo
刊行年月日: 2025-09-14
更新時刻: 2025-12-02 08:30:07 +0900

Roadmap on atomically-engineered quantum platforms

ジャーナル論文
著者: Soo-hyon Phark (author) (この著者で検索)

https://orcid.org/0000-0002-0541-5083 (unauthenticated)

Institute for Basic Science (IBS)

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Bent Weber (author) (この著者で検索)

https://orcid.org/0000-0001-8586-127X (unauthenticated)

Nanyang Technological University

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Yasuo Yoshida (author) (この著者で検索)

https://orcid.org/0000-0002-7311-555X (unauthenticated)

Kanazawa University

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Patrick R Forrester (author) (この著者で検索)

https://orcid.org/0000-0001-8882-9048 (unauthenticated)

Harvard University

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Robertus J G Elbertse (author) (この著者で検索)

https://orcid.org/0000-0002-1429-1297 (unauthenticated)

University of Maryland, College Park

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Joseph A Stroscio (author) (この著者で検索)

National Institute of Standards and Technology

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Hao Wang (author) (この著者で検索)

University of Chinese Academy of Sciences

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Kai Yang (author) (この著者で検索)

https://orcid.org/0000-0002-5863-3666 (unauthenticated)

University of Chinese Academy of Sciences

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Leo Gross (author) (この著者で検索)

IBM Research Europe

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Shantanu Mishra (author) (この著者で検索)

https://orcid.org/0000-0002-2900-4203 (unauthenticated)

IBM Research Europe

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Fabian Paschke (author) (この著者で検索)

IBM Research Europe

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Katharina Kaiser (author) (この著者で検索)

Georg-August-Universität Göttingen

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Shadi Fatayer (author) (この著者で検索)

King Abdullah University of Science and Technology

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Jascha Repp (author) (この著者で検索)

https://orcid.org/0000-0003-2883-7083 (unauthenticated)

University of Regensburg

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Harry L Anderson (author) (この著者で検索)

Oxford University

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Diego Peña (author) (この著者で検索)

https://orcid.org/0000-0003-3814-589X (unauthenticated)

Universidade de Santiago de Compostela

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Florian Albrecht (author) (この著者で検索)

https://orcid.org/0000-0002-7418-9155 (unauthenticated)

IBM Research Europe

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Franz J Giessibl (author) (この著者で検索)

https://orcid.org/0000-0002-5585-1326 (unauthenticated)

University of Regensburg

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Roman Fasel (author) (この著者で検索)

Empa-Swiss Federal Laboratories for Materials Science and Technology

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Joaquín Fernández-Rossier (author) (この著者で検索)

International Iberian Nanotechnology Laboratory

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Shigeki Kawai (author) (この著者で検索)

https://orcid.org/0000-0003-2128-0120

National Institute for Materials Science

NIMS Researchers Directory SAMURAI

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Laurent Limot (author) (この著者で検索)

Université de Strasbourg, CNRS

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Nicolás Lorente (author) (この著者で検索)

Centro de Física de Materiales CFM/MPC

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Berthold Jäck (author) (この著者で検索)

https://orcid.org/0000-0003-3826-0855 (unauthenticated)

Hong-Kong University of Science and Technology

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Haonan Huang (author) (この著者で検索)

https://orcid.org/0000-0003-4059-0351 (unauthenticated)

Princeton University

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Joachim Ankerhold (author) (この著者で検索)

https://orcid.org/0000-0002-6510-659X (unauthenticated)

University of Ulm

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Christian R Ast (author) (この著者で検索)

https://orcid.org/0000-0002-7469-1188 (unauthenticated)

Max-Planck-Institute for Solid State Research

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Martina Trahms (author) (この著者で検索)

Freie Universität Berlin

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Clemens B Winkelmann (author) (この著者で検索)

https://orcid.org/0000-0003-4320-994X (unauthenticated)

University Grenoble Alpes, CEA, Grenoble INP

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Katharina J Franke (author) (この著者で検索)

https://orcid.org/0000-0001-9416-023X (unauthenticated)

Freie Universität Berlin

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Martina O Soldini (author) (この著者で検索)

University of Zurich

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Glenn Wagner (author) (この著者で検索)

University of Zurich

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Titus Neupert (author) (この著者で検索)

https://orcid.org/0000-0003-0604-041X (unauthenticated)

University of Zurich

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Felix Küster (author) (この著者で検索)

Max Planck Institute of Microstructure Physics

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Souvik Das (author) (この著者で検索)

Max Planck Institute of Microstructure Physics

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Stuart S P Parkin (author) (この著者で検索)

Max Planck Institute of Microstructure Physics

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Paolo Sessi (author) (この著者で検索)

Max Planck Institute of Microstructure Physics

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Zhenyu Wang (author) (この著者で検索)

https://orcid.org/0000-0002-4857-7234 (unauthenticated)

University of Science and Technology of China

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Vidya Madhavan (author) (この著者で検索)

University of Illinois Urbana-Champaign

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Rupert Huber (author) (この著者で検索)

https://orcid.org/0000-0001-6617-9283 (unauthenticated)

University of Regensburg

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Gagandeep Singh (author) (この著者で検索)

https://orcid.org/0000-0002-1884-6640 (unauthenticated)

Nanyang Technological University

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Fabio Donati (author) (この著者で検索)

https://orcid.org/0000-0002-3932-2889 (unauthenticated)

Center for Quantum Nanoscience (QNS)

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Stefano Rusponi (author) (この著者で検索)

École Polytechnique Fédérale de Lausanne

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Harald Brune (author) (この著者で検索)

École Polytechnique Fédérale de Lausanne

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Eufemio Moreno-Pineda (author) (この著者で検索)

Universidad De Panama

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Mario Ruben (author) (この著者で検索)

Karlsruhe Institute of Technology (KIT)

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Wolfgang Wernsdorfer (author) (この著者で検索)

Karlsruhe Institute of Technology (KIT)

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Wantong Huang (author) (この著者で検索)

https://orcid.org/0000-0002-4081-3861 (unauthenticated)

Karlsruhe Institute of Technology (KIT)

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Kwan Ho Au-Yeung (author) (この著者で検索)

https://orcid.org/0000-0003-2953-7955 (unauthenticated)

Karlsruhe Institute of Technology (KIT)

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Philip Willke (author) (この著者で検索)

https://orcid.org/0000-0002-7215-8419 (unauthenticated)

Karlsruhe Institute of Technology (KIT)

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Andreas J Heinrich (author) (この著者で検索)

Institute for Basic Science (IBS)

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Susanne Baumann (author) (この著者で検索)

https://orcid.org/0000-0002-3821-494X (unauthenticated)

University of Stuttgart

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Sebastian Loth (author) (この著者で検索)

https://orcid.org/0000-0002-1587-3678 (unauthenticated)

University of Stuttgart

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Lukas M Veldman (author) (この著者で検索)

https://orcid.org/0000-0002-3854-0673 (unauthenticated)

University of Stuttgart

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Sander Otte (author) (この著者で検索)

Delft University of Technology

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Christoph Wolf (author) (この著者で検索)

https://orcid.org/0000-0002-9340-9782 (unauthenticated)

Institute for Basic Science (IBS)

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Lisanne Sellies (author) (この著者で検索)

https://orcid.org/0000-0001-6463-8642 (unauthenticated)

IBM Research Europe

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Steven R Schofield (author) (この著者で検索)

https://orcid.org/0000-0002-0727-3015 (unauthenticated)

University College London

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Michael E Flatté (author) (この著者で検索)

https://orcid.org/0000-0001-5093-1549 (unauthenticated)

University of Iowa

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Joris G Keizer (author) (この著者で検索)

https://orcid.org/0000-0001-5341-4774 (unauthenticated)

University of New South Wales Sydney

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Michelle Y Simmons (author) (この著者で検索)

https://orcid.org/0000-0002-6422-5888 (unauthenticated)

University of New South Wales Sydney
キーワード: Scanning tunneling microscopy, Atomic-scale engineering, Quantum materials, Single spin manipulation, Nanotechnology, Atomically-engineered quantum platforms, Electron spin resonance
刊行年月日: 2025-09-30
更新時刻: 2025-11-20 16:30:04 +0900

Designing composition ratio of magnetic alloy multilayer for transverse thermoelectric conversion by Bayesian optimization

ジャーナル論文
著者: Naoki Chiba (author) (この著者で検索)

https://orcid.org/0009-0003-0296-9026 (unauthenticated)

National Institute for Materials Science

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Keisuke Masuda (author) (この著者で検索)

https://orcid.org/0000-0002-6884-6390

National Institute for Materials Science

NIMS Researchers Directory SAMURAI

;

Ken-ichi Uchida (author) (この著者で検索)

https://orcid.org/0000-0001-7680-3051

National Institute for Materials Science

NIMS Researchers Directory SAMURAI

;

Yoshio Miura (author) (この著者で検索)

https://orcid.org/0000-0002-5605-5452

National Institute for Materials Science

NIMS Researchers Directory SAMURAI
キーワード: Spin-orbit interactions, First-principle calculations, Superlattices, Informatics, Machine learning, Ferromagnetic materials, Multilayers, Thermoelectric effects
刊行年月日: 2023-06-01
更新時刻: 2024-05-25 08:30:17 +0900

Pretreatment-free SERS sensing of microplastics using a self-attention-based neural network on hierarchically porous Ag foams

ジャーナル論文
著者: Olga Guselnikova (author) (この著者で検索)

https://orcid.org/0000-0002-2594-9605 (unauthenticated)

;

Andrii Trelin (author) (この著者で検索)

;

Yunqing Kang (author) (この著者で検索)

National Institute for Materials Science

;

Pavel Postnikov (author) (この著者で検索)

;

Makoto Kobashi (author) (この著者で検索)

;

Asuka Suzuki (author) (この著者で検索)

;

Lok Kumar Shrestha (author) (この著者で検索)

https://orcid.org/0000-0003-2680-6291

National Institute for Materials Science

NIMS Researchers Directory SAMURAI

;

Joel Henzie (author) (この著者で検索)

https://orcid.org/0000-0002-9190-2645

National Institute for Materials Science

NIMS Researchers Directory SAMURAI

;

Yusuke Yamauchi (author) (この著者で検索)

National Institute for Materials Science
キーワード: SERS, Microplastics, Plasmonics, Machine Learning, Self-attention-based neural networks
刊行年月日: 2024-05-28
更新時刻: 2024-08-20 12:30:25 +0900

Computational material screening for electrode materials of BaSi2 solar cells

ジャーナル論文
著者: Tomoaki Yazaki (author) (この著者で検索)

University of Yamanashi a Center for Crystal Science and Technology

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Keisuke Arimoto (author) (この著者で検索)

;

Junji Yamanaka (author) (この著者で検索)

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Kosuke O. Hara (author) (この著者で検索)
キーワード: Solar cells, metallic electrode, high-throughput virtual screening, work function, melting point, density functional theory
刊行年月日: 2026-12-31
更新時刻: 2026-03-07 12:30:04 +0900

Autonomous search for half-metallic materials with B 2 structure

ジャーナル論文
著者: Yuma Iwasaki (author) (この著者で検索)

https://orcid.org/0000-0002-7117-277X

NIMS Researchers Directory SAMURAI

;

Ryo Toyama (author) (この著者で検索)

https://orcid.org/0000-0002-7398-5803

NIMS Researchers Directory SAMURAI

;

Takahiro Yamazaki (author) (この著者で検索)

https://orcid.org/0000-0003-0738-9373 (unauthenticated)

;

Yasuhiko Igarashi (author) (この著者で検索)

https://orcid.org/0000-0003-1042-6657 (unauthenticated)

;

Masato Kotsugi (author) (この著者で検索)

https://orcid.org/0000-0002-4841-1808 (unauthenticated)

;

Yuya Sakuraba (author) (この著者で検索)

https://orcid.org/0000-0003-4618-9550

NIMS Researchers Directory SAMURAI
キーワード: Machine learning, Autonomous, ab initio, Half metal
刊行年月日: 2024-12-31
更新時刻: 2024-10-04 08:30:32 +0900

Advanced Science - 2026 - Fajar - Generative AI‐Driven Accelerated Discovery of Passivation Molecules for Perovskite Solar (1).pdf

Generative AI‐Driven Accelerated Discovery of Passivation Molecules for Perovskite Solar Cells

ジャーナル論文
著者: Adroit T. N. Fajar (author) (この著者で検索)

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Guillaume Lambard (author) (この著者で検索)

https://orcid.org/0000-0003-0275-4079

National Institute for Materials Science

NIMS Researchers Directory SAMURAI

;

Jessie Manopo (author) (この著者で検索)

;

Ruili Guo (author) (この著者で検索)

;

Kevin Septioga (author) (この著者で検索)

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Rizfi F. Pari (author) (この著者で検索)

;

Toshinori Matsushima (author) (この著者で検索)

;

Zhanglin Guo (author) (この著者で検索)
キーワード: Generative AI, Passivation Molecules, Perovskite Solar Cells
刊行年月日: 2026-04-02
更新時刻: 2026-07-02 14:43:51 +0900