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892 件のレコードが見つかりました。

A data-driven elucidation of the challenges in designing stable quinone derivatives for aqueous organic redox flow batteries  correlations between the.pdf
A data-driven elucidation of the challenges in designing stable quinone derivatives for aqueous organic redox flow batteries: correlations between thermodynamics of chemical degradation and energy capacity metrics
ジャーナル論文
著者
Ning Lu (author) (この著者で検索)
RWTH Aachen University a MODES, the Integrated Fuel & Chemical Science Centre
;
Shiyao Ju (author) (この著者で検索)
;
Daniel Willimetz (author) (この著者で検索)
;
Shengming Tang (author) (この著者で検索)
;
Abhishek Khetan (author) (この著者で検索)
キーワード
Aqueous organic redox flow batteries, quinone stability, degradation, molecular design, high-throughput screening, durability, grid-scale energy storage
刊行年月日
2026-07-16
更新時刻
2026-07-17 13:28:23 +0900

Simple implementation examples of agent AI on free energy calculation and phase-field simulation.pdf
Simple implementation examples of agent AI on free energy calculation and phase-field simulation
ジャーナル論文
著者
Toshiyuki Koyama (author) (この著者で検索)
ORCID ; ORCID SAMURAI ; ORCID SAMURAI
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

TC071.png
MDR SuperCon Datasheet Readme
その他
コレクション
MDR SuperCon Datasheet
著者
Materials Database Group (editor) (この著者で検索)
National Institute for Materials Science
キーワード
SuperCon, Superconductors, Oxide, Metallic, Organic, Readme
刊行年月日
更新時刻
2023-12-25 00:30:37 +0900

TC071.png
MDR SuperCon Datasheet Readme Ver.2.0
その他
コレクション
MDR SuperCon Datasheet
著者
Masashi Ishii (editor) (この著者で検索)
ORCID SAMURAI
キーワード
SuperCon, Superconductors, Oxide, Metallic, Organic, Readme
刊行年月日
更新時刻
2024-05-14 16:30:22 +0900

1-s2.0-S2949747725000065-main (3).pdf
Generating eco-friendly ionic liquids with enhanced CO2 solubility using language models
ジャーナル論文
著者
Adroit T.N. Fajar (author) (この著者で検索)
;
Guillaume Lambard (author) (この著者で検索)
ORCID SAMURAI ;
Md. Amirul Islam (author) (この著者で検索)
;
Bidyut B. Saha (author) (この著者で検索)
;
Zakiah D. Nurfajrin (author) (この著者で検索)
;
Kevin Septioga (author) (この著者で検索)
キーワード
Generative model, GPT, Prediction, SMILES, Decarbonization
刊行年月日
2025-05-22
更新時刻
2025-12-10 08:30:26 +0900

Inorg Chem_63_20975_2024_MDR.pdf
Possible Superconductivity for Layered Metal Boride Carbide Compounds MB2C2 (M = Alkali, Alkaline-Earth, or Rare-Earth Metals)
ジャーナル論文
著者
Wataru Hayami (author) (この著者で検索)
ORCID SAMURAI ;
Xavier Rocquefelte (author) (この著者で検索)
;
Jean-François Halet (author) (この著者で検索)
ORCID
キーワード
boron, carbon, superconductivity, B2C2, layered material
刊行年月日
2024-11-04
更新時刻
2025-10-23 08:30:15 +0900

MANUSCRIPT JECE.pdf
Efficient chromium (VI) removal from wastewater by adsorption-assisted photocatalysis using MXene
ジャーナル論文
著者
Nur Shafiqah Jamaluddin (author) (この著者で検索)
Universiti Teknologi MARA
;
Nur Hashimah Alias (author) (この著者で検索)
Universiti Teknologi MARA
;
Sadaki Samitsu (author) (この著者で検索)
National Institute for Materials Science Research Center for Macromolecules and Biomaterials/Macromolecules Field/Data-driven Polymer Design Group
ORCID SAMURAI ;
Nur Hidayati Othman (author) (この著者で検索)
Universiti Teknologi MARA
;
Juhana Jaafar (author) (この著者で検索)
Universiti Teknologi Malaysia
;
Fauziah Marpani (author) (この著者で検索)
Universiti Teknologi MARA
;
Woei Jye Lau (author) (この著者で検索)
Universiti Teknologi Malaysia
;
Yong Zen Tan (author) (この著者で検索)
Nanyang Technological University
キーワード
MXene, chromium (VI), adsorption, photocatalysis, wastewater
刊行年月日
2022-09-30
更新時刻
2024-09-30 08:30:09 +0900

2403.03588v3.pdf
Projector-based efficient estimation of force constants
ジャーナル論文
著者
Atsuto Seko (author) (この著者で検索)
ORCID ;
Atsushi Togo (author) (この著者で検索)
ORCID SAMURAI
キーワード
force constants, phonon, space group, symmetry
刊行年月日
2024-12-02
更新時刻
2024-12-07 12:30:26 +0900

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