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Simple implementation examples of agent AI on free energy calculation and phase-field simulation
- ジャーナル論文
- 著者
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Toshiyuki Koyama (author) (この著者で検索)
https://orcid.org/0000-0001-7424-4858
(unauthenticated)
;
Yusuke Matsuoka (author) (この著者で検索)
;
Akimitsu Ishii (author) (この著者で検索)
- キーワード
- generative AI, LLM, LangGraph, Gibbs energy, Phase-field method, Jarzynski equality
- 刊行年月日
- 2026-12-31
- 更新時刻
- 2026-02-08 08:30:08 +0900
Preprocessing Method for Spectra Interpreted by the Power Law Using Segment Regression
- ジャーナル論文
- 著者
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Shinjiro Yagyu (author) (この著者で検索)
;
Michiko Yoshitake (author) (この著者で検索)
;
Takahiro Nagata (author) (この著者で検索)
- キーワード
- Photoelectron Yield Spectroscopy:, segment regression, Power Law
- 刊行年月日
- 2024-11-26
- 更新時刻
- 2024-12-04 14:52:47 +0900
Two displacive ferroelectric phase transitions in multiferroic quadruple perovskite
- ジャーナル論文
- 著者
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A. Maia (author) (この著者で検索)
https://orcid.org/0000-0002-0582-7272
(unauthenticated)
;
M. Kempa (author) (この著者で検索)
https://orcid.org/0000-0002-5902-7780
(unauthenticated)
;
V. Bovtun (author) (この著者で検索)
https://orcid.org/0000-0002-2470-6767
(unauthenticated)
;
R. Vilarinho (author) (この著者で検索)
https://orcid.org/0000-0001-6104-9834
(unauthenticated)
;
C. Kadlec (author) (この著者で検索)
https://orcid.org/0000-0003-2820-4462
(unauthenticated)
;
J. Agostinho Moreira (author) (この著者で検索)
https://orcid.org/0000-0003-4659-7503
(unauthenticated)
;
A. A. Belik (author) (この著者で検索)
;
P. Proschek (author) (この著者で検索)
https://orcid.org/0000-0003-2627-3544
(unauthenticated)
;
S. Kamba (author) (この著者で検索)
https://orcid.org/0000-0003-4699-869X
(unauthenticated)
- キーワード
- BiMn7O12, perovskites, multiferroic, ferroelectric transition
- 刊行年月日
- 2024-04-25
- 更新時刻
- 2024-05-02 16:30:12 +0900
Advancing Efficiency and Stability of Lead, Tin, and Lead/Tin Perovskite Solar Cells: Strategies and Perspectives
- ジャーナル論文
- 著者
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Dhruba B. Khadka (author) (この著者で検索)National Institute for Materials Science
;
Yasuhiro Shirai (author) (この著者で検索)National Institute for Materials Science
;
Masatoshi Yanagida (author) (この著者で検索)National Institute for Materials Science
;
;James W. Ryan (author) (この著者で検索);Zhaoning Song (author) (この著者で検索);Bobby G. Barker (author) (この著者で検索);Tara P. Dhakal (author) (この著者で検索)Kenjiro Miyano (author) (この著者で検索)National Institute for Materials Science
- キーワード
- Perovskite solar cells, Interface engineering, Device stability, Sn-Pb perovskite, Tin perovskite
- 刊行年月日
- 2023-08-30
- 更新時刻
- 2024-11-28 16:30:38 +0900
Materials Acceleration Platforms (MAPs): Accelerating Materials Research and Development to Meet Urgent Societal Challenges
- ジャーナル論文
- 著者
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Simon P. Stier (author) (この著者で検索)
https://orcid.org/0000-0003-0410-3616
(unauthenticated)
;
;Christoph Kreisbeck (author) (この著者で検索);Holger Ihssen (author) (この著者で検索)Matthias Albert Popp (author) (この著者で検索)
https://orcid.org/0000-0001-7620-1245
(unauthenticated)
;
Jens Hauch (author) (この著者で検索)
https://orcid.org/0000-0003-4384-2112
(unauthenticated)
;
Kourosh Malek (author) (この著者で検索)
https://orcid.org/0000-0002-3021-0813
(unauthenticated)
;
Marine Reynaud (author) (この著者で検索)
https://orcid.org/0000-0002-0156-8701
(unauthenticated)
;
;T.P.M. Goumans (author) (この著者で検索)Johan Carlsson (author) (この著者で検索)
https://orcid.org/0000-0002-1596-0923
(unauthenticated)
;
;Ilian Todorov (author) (この著者で検索)Lukas Gold (author) (この著者で検索)
https://orcid.org/0000-0001-7444-2969
(unauthenticated)
;
Andreas Räder (author) (この著者で検索)
https://orcid.org/0000-0002-2673-0832
(unauthenticated)
;
Wolfgang Wenzel (author) (この著者で検索)
https://orcid.org/0000-0001-9487-4689
(unauthenticated)
;
Shahbaz Tareq Bandesha (author) (この著者で検索)
https://orcid.org/0000-0002-9365-8703
(unauthenticated)
;
;Philippe Jacques (author) (この著者で検索)Francisco Garcia‐Moreno (author) (この著者で検索)
https://orcid.org/0000-0001-6114-0240
(unauthenticated)
;
Oier Arcelus (author) (この著者で検索)
https://orcid.org/0000-0001-9075-3820
(unauthenticated)
;
Pascal Friederich (author) (この著者で検索)
https://orcid.org/0000-0003-4465-1465
(unauthenticated)
;
Simon Clark (author) (この著者で検索)
https://orcid.org/0000-0002-8758-6109
(unauthenticated)
;
Mario Maglione (author) (この著者で検索)
https://orcid.org/0000-0002-5747-8879
(unauthenticated)
;
Anssi Laukkanen (author) (この著者で検索)
https://orcid.org/0000-0002-2308-744X
(unauthenticated)
;
Ivano Eligio Castelli (author) (この著者で検索)
https://orcid.org/0000-0001-5880-5045
(unauthenticated)
;
Javier Carrasco (author) (この著者で検索)
https://orcid.org/0000-0003-3117-6933
(unauthenticated)
;
Montserrat Casas Cabanas (author) (この著者で検索)
https://orcid.org/0000-0002-9298-2333
(unauthenticated)
;
Helge Sören Stein (author) (この著者で検索)
https://orcid.org/0000-0002-3461-0232
(unauthenticated)
;
Ozlem Ozcan (author) (この著者で検索)
https://orcid.org/0000-0003-1965-7996
(unauthenticated)
;
David Elbert (author) (この著者で検索)
https://orcid.org/0000-0002-2292-180X
(unauthenticated)
;
Karsten Reuter (author) (この著者で検索)
https://orcid.org/0000-0001-8473-8659
(unauthenticated)
;
;Christoph Scheurer (author) (この著者で検索)Masahiko Demura (author) (この著者で検索)
;
;Sang Soo Han (author) (この著者で検索)Tejs Vegge (author) (この著者で検索)
https://orcid.org/0000-0002-1484-0284
(unauthenticated)
;
Sawako Nakamae (author) (この著者で検索)
https://orcid.org/0000-0001-9174-3165
(unauthenticated)
;
Monica Fabrizio (author) (この著者で検索)
https://orcid.org/0000-0003-2257-8375
(unauthenticated)
;
Mark Kozdras (author) (この著者で検索)
https://orcid.org/0000-0001-5113-3047
(unauthenticated)
- キーワード
- advanced materials, artificial intelligence, autonomous labs, materials acceleration platforms, societal challenges
- 刊行年月日
- 2024-09-06
- 更新時刻
- 2024-11-11 16:30:34 +0900
Beyond Single-Reference Fixed-Node Approximation in Ab Initio Diffusion Monte Carlo Using Antisymmetrized Geminal Power Applied to Systems with Hundreds of Electrons
- ジャーナル論文
- 著者
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Kousuke Nakano (author) (この著者で検索)National Institute for Materials Science
;
;Sandro Sorella (author) (この著者で検索);Dario Alfè (author) (この著者で検索)Andrea Zen (author) (この著者で検索)
- キーワード
- 第一原理量子モンテカルロ法, 拡散量子モンテカルロ法
- 刊行年月日
- 2024-06-11
- 更新時刻
- 2024-08-27 08:30:13 +0900
2023 Roadmap on molecular modelling of electrochemical energy materials
- ジャーナル論文
- 著者
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;Chao Zhang (author) (この著者で検索);Jun Cheng (author) (この著者で検索);Yiming Chen (author) (この著者で検索);Maria K Y Chan (author) (この著者で検索);Qiong Cai (author) (この著者で検索);Rodrigo P Carvalho (author) (この著者で検索);Cleber F N Marchiori (author) (この著者で検索);Daniel Brandell (author) (この著者で検索);C Moyses Araujo (author) (この著者で検索);Ming Chen (author) (この著者で検索);Xiangyu Ji (author) (この著者で検索);Guang Feng (author) (この著者で検索);Kateryna Goloviznina (author) (この著者で検索);Alessandra Serva (author) (この著者で検索);Mathieu Salanne (author) (この著者で検索)Toshihiko Mandai (author) (この著者で検索)National Institute for Materials Science (NIMS)
;
;Tomooki Hosaka (author) (この著者で検索);Mirna Alhanash (author) (この著者で検索);Patrik Johansson (author) (この著者で検索);Yun-Ze Qiu (author) (この著者で検索);Hai Xiao (author) (この著者で検索);Michael Eikerling (author) (この著者で検索);Ryosuke Jinnouchi (author) (この著者で検索);Marko M Melander (author) (この著者で検索);Georg Kastlunger (author) (この著者で検索);Assil Bouzid (author) (この著者で検索);Alfredo Pasquarello (author) (この著者で検索);Seung-Jae Shin (author) (この著者で検索);Minho M Kim (author) (この著者で検索);Hyungjun Kim (author) (この著者で検索);Kathleen Schwarz (author) (この著者で検索)Ravishankar Sundararaman (author) (この著者で検索)
- キーワード
- electrochemical interfaces, density-functional theory, molecular dynamics simulation, electrochemical energy storage, machine learning, electrocatalysis
- 刊行年月日
- 2023-10-01
- 更新時刻
- 2024-03-22 00:53:39 +0900
Transforming surgical planning and procedures through the synergistic use of additive manufacturing, advanced materials and artificial intelligence: challenges and opportunities
- ジャーナル論文
- 著者
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;Shivi Tripathi (author) (この著者で検索);Aftab Alam Ansari (author) (この著者で検索);Manisha Singh (author) (この著者で検索);Madhusmita Dash (author) (この著者で検索)Prasoon Kumar (author) (この著者で検索)
https://orcid.org/0000-0003-0854-3889
(unauthenticated)
;
;Harpreet Singh (author) (この著者で検索);Biranchi Panda (author) (この著者で検索);Syam Nukavarapu (author) (この著者で検索)Gulden Camci-Unal (author) (この著者で検索)
https://orcid.org/0000-0003-4258-844X
(unauthenticated)
;
;Bingbing Li (author) (この著者で検索);Prashant Kumar Jain (author) (この著者で検索);Rengaswamy Jayaganthan (author) (この著者で検索);Hassan Mehboob (author) (この著者で検索)Harri Junaedi (author) (この著者で検索)
https://orcid.org/0000-0001-7627-4006
(unauthenticated)
;
Himansu Sekhar Nanda (author) (この著者で検索)
https://orcid.org/0000-0001-5558-9885
(unauthenticated)
;
Guoping Chen (author) (この著者で検索)
;
Subhas C. Kundu (author) (この著者で検索)
https://orcid.org/0000-0002-7170-2291
(unauthenticated)
- キーワード
- 3D printing, additive manufacturing
- 刊行年月日
- 2025-06-11
- 更新時刻
- 2025-12-04 17:56:26 +0900
Polarized terahertz electromagnetic-wave radiation from cuprate superconductor Bi2212 mesa structures
- ジャーナル論文
- 著者
-
;Asem Elarabi (author) (この著者で検索);Yoshito Saito (author) (この著者で検索)National Institute for Materials Science;Hidehiro Asai (author) (この著者で検索);Ryota Kobayashi (author) (この著者で検索);Ken Hayama (author) (この著者で検索);Keiichiro Maeda (author) (この著者で検索);Shuma Fujita (author) (この著者で検索);Yusuke Yoshioka (author) (この著者で検索)Yoshihiko Takano (author) (この著者で検索)National Institute for Materials Science
;
;Manabu Tsujimoto (author) (この著者で検索)Itsuhiro Kakeya (author) (この著者で検索)
- キーワード
- terahertz, superconductor, Bi2212
- 刊行年月日
- 2024-02-29
- 更新時刻
- 2024-07-04 16:32:07 +0900