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42 件のレコードが見つかりました。 1件目から10件目まで表示します。

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

c7cp08280k.pdf
Liquid electrolyte informatics using an exhaustive search with linear regression
データセット
著者
SODEYAMA, Keitaro (author) (この著者で検索)
ORCID SAMURAI ;
IGARASHI, Yasuhiko (author) (この著者で検索)
ORCID ;
NAKAYAMA, Tomofumi (author) (この著者で検索)
ORCID ;
TATEYAMA, Yoshitaka (author) (この著者で検索)
ORCID SAMURAI ;
OKADA, Masato (author) (この著者で検索)
ORCID
キーワード
molecules, Li-ion battery, quantum chemistry calculations, materials informatics, Gaussian09, organic solvents
刊行年月日
2018-06-14
更新時刻
2024-02-08 17:54:30 +0900

Cr2Ge2Te6_Manuscript_submit230607.pdf
Two-step electronic response to magnetic ordering in a van der Waals ferromagnet
ジャーナル論文
著者
Han Wu (author) (この著者で検索)
Rice University
;
Jian-Xin Zhu (author) (この著者で検索)
Los Alamos National Laboratory
;
Lebing Chen (author) (この著者で検索)
University of California at Berkeley
;
Matthew W. Butcher (author) (この著者で検索)
Rice University
;
Ziqin Yue (author) (この著者で検索)
Rice University
;
Dongsheng Yuan (author) (この著者で検索)
National Institute for Materials Science Research Center for Electronic and Optical Materials/Optical Materials Field/Optical Single Crystals Group
ORCID SAMURAI ;
Yu He (author) (この著者で検索)
Yale University
;
Ji Seop Oh (author) (この著者で検索)
Rice University
;
Bin Gao (author) (この著者で検索)
Rice University
;
Jianwei Huang (author) (この著者で検索)
Rice University
;
Shan Wu (author) (この著者で検索)
University of California at Berkeley
;
Cheng Gong (author) (この著者で検索)
University of Maryland, College Park
;
Yucheng Guo (author) (この著者で検索)
Rice University
;
Sung-Kwan Mo (author) (この著者で検索)
Lawrence Berkeley National Laboratory
;
Jonathan Denlinger (author) (この著者で検索)
Lawrence Berkeley National Laboratory
;
Donghui Lu (author) (この著者で検索)
SLAC National Accelerator Laboratory
;
Makoto Hashimoto (author) (この著者で検索)
SLAC National Accelerator Laboratory
;
Matthew B. Stone (author) (この著者で検索)
Oak Ridge National Laboratory (ORNL)
;
Alexander I. Kolesnikov (author) (この著者で検索)
Oak Ridge National Laboratory (ORNL)
;
Songxue Chi (author) (この著者で検索)
Oak Ridge National Laboratory (ORNL)
;
Junichiro Kono (author) (この著者で検索)
Rice University
;
Andriy H. Nevidomskyy (author) (この著者で検索)
Rice University
;
Robert J. Birgeneau (author) (この著者で検索)
University of California at Berkeley
;
Pengcheng Dai (author) (この著者で検索)
Rice University
;
Ming Yi (author) (この著者で検索)
Rice University
キーワード
Magnetic order, Electronic structure, Magnetic phase transitions, Van der Waals systems, Angle-resolved photoemission spectroscopy
刊行年月日
2024-01-12
更新時刻
2024-11-19 16:30:44 +0900

IMFP VIII_Author Manuscript2.pdf
Calculations of electron inelastic mean free paths.VIII. Data for 15 elemental solids over the 50-2000 eV range
ジャーナル論文
著者
TANUMA, Shigeo (author) (この著者で検索)
ORCID SAMURAI ;
C.J. Powell (author) (この著者で検索)
;
D.R. Penn (author) (この著者で検索)
キーワード
IMFP, electron inelastic mean free path, Li, Be, diamond, graphite, Na, K, Sc, Ge, In, Sn, Cs, Gd, Tb, Dy, Al, TPP-2M equation, rare-earth elements
刊行年月日
2005-01-10
更新時刻
2024-01-05 22:13:47 +0900

d4qi02834a.pdf
J-dimers of phthalocyanine analogues: structural characterization and their use for determination of association constants between ligands and the central cation
ジャーナル論文
著者
Jiri Demuth (author) (この著者で検索)
ORCID ;
Stefan Bednarik (author) (この著者で検索)
;
Radek Machan (author) (この著者で検索)
;
Ivan Mocak (author) (この著者で検索)
;
Tibor Malinsky (author) (この著者で検索)
;
Mona Abo El Dahabova (author) (この著者で検索)
;
Jakub Holcak (author) (この著者で検索)
;
Miroslav Miletin (author) (この著者で検索)
ORCID ; ORCID SAMURAI ;
Veronika Novakova (author) (この著者で検索)
ORCID ;
Petr Zimcik (author) (この著者で検索)
ORCID
キーワード
phthalocyanine, J-dimers, supramolecular system, association constant, ligand
刊行年月日
2024-12-31
更新時刻
2025-02-13 12:30:44 +0900

Group 8 metallocenes as single-source precursors for the synthesis of light-element-stabilized FCC phases under extreme conditions.pdf
Group 8 metallocenes as single-source precursors for the synthesis of light-element-stabilized FCC phases under extreme conditions
ジャーナル論文
著者
Ken Niwa (author) (この著者で検索)
Nagoya University a Research Center for Crystalline Materials Engineering, Faculty of Engineering
;
Kenta Nakashima (author) (この著者で検索)
;
Yusuke Kimura (author) (この著者で検索)
;
Nico Alexander Gaida (author) (この著者で検索)
;
Takuya Sasaki (author) (この著者で検索)
;
Masashi Hasegawa (author) (この著者で検索)
キーワード
Metallocenes, high pressure synthesis, laser-heated diamond-anvil cell, high pressure in situ measurement
刊行年月日
2026-12-31
更新時刻
2026-06-24 11:49:59 +0900

Supplemental_material_v4.pdf
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
;
Keisuke Arimoto (author) (この著者で検索)
;
Junji Yamanaka (author) (この著者で検索)
;
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

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