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1234 件のレコードが見つかりました。
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
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;Flaviano Della Pia (author) (この著者で検索);Benjamin X. Shi (author) (この著者で検索);Yasmine S. Al-Hamdani (author) (この著者で検索);Dario Alfé (author) (この著者で検索);Tyler A. Anderson (author) (この著者で検索);Matteo Barborini (author) (この著者で検索);Anouar Benali (author) (この著者で検索);Michele Casula (author) (この著者で検索);Neil D. Drummond (author) (この著者で検索);Matúš Dubecký (author) (この著者で検索);Claudia Filippi (author) (この著者で検索);Paul R. C. Kent (author) (この著者で検索);Jaron T. Krogel (author) (この著者で検索);Pablo López Ríos (author) (この著者で検索);Arne Lüchow (author) (この著者で検索);Ye Luo (author) (この著者で検索);Angelos Michaelides (author) (この著者で検索);Lubos Mitas (author) (この著者で検索)Kousuke Nakano (author) (この著者で検索)National Institute for Materials Science
;
;Richard J. Needs (author) (この著者で検索);Manolo C. Per (author) (この著者で検索);Anthony Scemama (author) (この著者で検索);Jil Schultze (author) (この著者で検索);Ravindra Shinde (author) (この著者で検索);Emiel Slootman (author) (この著者で検索);Sandro Sorella (author) (この著者で検索);Alexandre Tkatchenko (author) (この著者で検索);Mike Towler (author) (この著者で検索);C. J. Umrigar (author) (この著者で検索);Lucas K. Wagner (author) (この著者で検索);William A. Wheeler (author) (この著者で検索);Haihan Zhou (author) (この著者で検索)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
MDTS: automatic complex materials design using Monte Carlo tree search
- ジャーナル論文
- 著者
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Tsuda, Koji (author) (この著者で検索)
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;Shiomi, Junichiro (author) (この著者で検索);Ju, Shenghong (author) (この著者で検索)Hou, Zhufeng (author) (この著者で検索)
https://orcid.org/0000-0002-0069-5573
(unauthenticated)
;
Dieb, Thaer M. (author) (この著者で検索)
;
Yoshizoe, Kazuki (author) (この著者で検索) - キーワード
- Monte Carlo tree search, materials design
- 刊行年月日
- 2017-12-31
- 更新時刻
- 2024-01-05 22:12:03 +0900
Hybrid Frenkel–Wannier excitons facilitate ultrafast energy transfer at a 2D–organic interface
- ジャーナル論文
- 著者
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;Wiebke Bennecke (author) (この著者で検索);Ignacio Gonzalez Oliva (author) (この著者で検索);Jan Philipp Bange (author) (この著者で検索);Paul Werner (author) (この著者で検索);David Schmitt (author) (この著者で検索);Marco Merboldt (author) (この著者で検索);Anna M. Seiler (author) (この著者で検索)Kenji Watanabe (author) (この著者で検索)National Institute for Materials Science
;
Takashi Taniguchi (author) (この著者で検索)National Institute for Materials Science
;
;Daniel Steil (author) (この著者で検索);R. Thomas Weitz (author) (この著者で検索);Peter Puschnig (author) (この著者で検索);Claudia Draxl (author) (この著者で検索);G. S. Matthijs Jansen (author) (この著者で検索);Marcel Reutzel (author) (この著者で検索)Stefan Mathias (author) (この著者で検索)
- キーワード
- hybrid excitons , 2D-organic interface , energy transfer
- 刊行年月日
- 2025-10-29
- 更新時刻
- 2026-03-03 08:30:21 +0900
Two-dimensional Nanoarchitectonics for Two-Dimensional Materials: Interfacial Engineering of Transition Metal Dichalcogenides
- ジャーナル論文
- 著者
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Pragati A. Shinde (author) (この著者で検索)
https://orcid.org/0000-0003-1730-2374
(unauthenticated)
National Institute for Materials Science Research Center for Materials Nanoarchitectonics
;
Katsuhiko Ariga (author) (この著者で検索)National Institute for Materials Science Research Center for Materials Nanoarchitectonics
- キーワード
- Nanoarchitectonics, Transition-metal dichalcogenides
- 刊行年月日
- 2023-12-19
- 更新時刻
- 2024-12-04 14:53:12 +0900
Raman scattering excitation in monolayers of semiconducting transition metal dichalcogenides
- ジャーナル論文
- 著者
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;M. Zinkiewicz (author) (この著者で検索);M. Grzeszczyk (author) (この著者で検索);T. Kazimierczuk (author) (この著者で検索);M. Bartos (author) (この著者で検索);K. Nogajewski (author) (この著者で検索);W. Pacuski (author) (この著者で検索)K. Watanabe (author) (この著者で検索)National Institute for Materials Science
;
T. Taniguchi (author) (この著者で検索)National Institute for Materials Science
;
;A. Wysmołek (author) (この著者で検索);P. Kossacki (author) (この著者で検索);M. Potemski (author) (この著者で検索);A. Babiński (author) (この著者で検索)M. R. Molas (author) (この著者で検索)
- キーワード
- Raman scattering excitation, semiconducting TMDs, exciton-phonon coupling
- 刊行年月日
- 2024-01-10
- 更新時刻
- 2025-02-23 22:47:59 +0900
Ultrafast dynamics of bright and dark excitons in monolayer WSe2 and heterobilayer WSe2/MoS2
- ジャーナル論文
- 著者
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;Jan Philipp Bange (author) (この著者で検索);Paul Werner (author) (この著者で検索);David Schmitt (author) (この著者で検索);Wiebke Bennecke (author) (この著者で検索);Giuseppe Meneghini (author) (この著者で検索);AbdulAziz AlMutairi (author) (この著者で検索);Marco Merboldt (author) (この著者で検索)Kenji Watanabe (author) (この著者で検索)National Institute for Materials Science
;
Takashi Taniguchi (author) (この著者で検索)National Institute for Materials Science
;
;Sabine Steil (author) (この著者で検索);Daniel Steil (author) (この著者で検索);R Thomas Weitz (author) (この著者で検索);Stephan Hofmann (author) (この著者で検索);G S Matthijs Jansen (author) (この著者で検索);Samuel Brem (author) (この著者で検索);Ermin Malic (author) (この著者で検索);Marcel Reutzel (author) (この著者で検索)Stefan Mathias (author) (この著者で検索)
- キーワード
- Optical excitations, hybrid excitons, charge-transfer processes
- 刊行年月日
- 2023-07-01
- 更新時刻
- 2025-02-25 16:30:36 +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
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
Spectroscopic studies of atomic defects and bandgap renormalization in semiconducting monolayer transition metal dichalcogenides
- ジャーナル論文
- 著者
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;Tae Young Jeong (author) (この著者で検索);Hakseong Kim (author) (この著者で検索);Sang-Jun Choi (author) (この著者で検索)Kenji Watanabe (author) (この著者で検索)National Institute for Materials Science
;
Takashi Taniguchi (author) (この著者で検索)National Institute for Materials Science
;
;Ki Ju Yee (author) (この著者で検索);Yong-Sung Kim (author) (この著者で検索)Suyong Jung (author) (この著者で検索)
- キーワード
- Atomic defect states, transition metal dichalcogenides, electron tunneling
- 刊行年月日
- 2019-08-23
- 更新時刻
- 2025-02-23 22:49:52 +0900
Covalent functionalization of transition metal dichalcogenides with perylene for light harvesting devices
- ジャーナル論文
- 著者
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;Ruben Canton-Vitoria (author) (この著者で検索);Yuki Matsunaga (author) (この著者で検索);Shaochun Zhang (author) (この著者で検索);Mengsong Xue (author) (この著者で検索)Minoru Osada (author) (この著者で検索)
https://orcid.org/0000-0002-6439-8068
(unauthenticated)
National Institute for Materials Science
;
Ryo Kitaura (author) (この著者で検索)National Institute for Materials Science
- キーワード
- 2D materials
- 刊行年月日
- 2025-02-27
- 更新時刻
- 2025-04-20 17:34:24 +0900