10000 件のレコードが見つかりました。

nakano-et-al-2024-beyond-single-reference-fixed-node-approximation-in-ab-initio-diffusion-monte-carlo-using.pdf
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
Kousuke Nakano (author) (この著者で検索)
ORCID SAMURAI ;
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

diff.pdf
Subphase exploration for SmFe12-based permanent magnets by Gibbs energies obtained with first-principles cluster-expansion method
ジャーナル論文
著者
Satoru Enomoto (author) (この著者で検索)
;
Sonju Kou (author) (この著者で検索)
;
Taichi Abe (author) (この著者で検索)
ORCID SAMURAI ;
Yoshihiro Gohda (author) (この著者で検索)
キーワード
Phase stability, CALHPAD, Ab initio calculations
刊行年月日
2023-04-11
更新時刻
2025-04-16 08:30:24 +0900

IMFP I_AuthorManuscript.pdf
Calculations of Electron Inelastic Mean Free Paths for 31 Materials
ジャーナル論文
著者
ORCID SAMURAI ;
Powell, C. J. (author) (この著者で検索)
National Bureau of Standards
;
Penn, D. R. (author) (この著者で検索)
National Bureau of Standards
キーワード
IMFP, inelastic mean free path, Bethe equation, TPP, elemental solids
刊行年月日
2004-09-15
更新時刻
2023-06-09 15:50:37 +0900

JPCM-123515 Final MS.pdf
Layered nanoarchitectonics for condensed hard matter, soft matter, and living matter
ジャーナル論文
著者
ORCID SAMURAI
キーワード
nanoarchitectonics, layered material, hard matter, hybrid, soft matter, living object
刊行年月日
2025-02-03
更新時刻
2025-11-18 08:30:16 +0900

Adv Funct Materials - 2026 - Deng - Atomic‐Scale Light Coupling Control in Ultrathin Photonic Membranes.pdf
Atomic‐Scale Light Coupling Control in Ultrathin Photonic Membranes
ジャーナル論文
著者
Chih‐Zong Deng (author) (この著者で検索)
ORCID ;
Chun‐Hao Chiang (author) (この著者で検索)
ORCID ;
Sunhao Shi (author) (この著者で検索)
;
Jui‐Han Fu (author) (この著者で検索)
; ORCID SAMURAI ;
Kuniaki Konishi (author) (この著者で検索)
ORCID ;
Vincent Tung (author) (この著者で検索)
ORCID ;
Chun‐Wei Chen (author) (この著者で検索)
ORCID ; ORCID SAMURAI
キーワード
nanomembranes, bound states in the continuum, light-matter interaction, atomic layers, ultrathin, transition metal dichalcogenide monolayers
刊行年月日
2026-04-03
更新時刻
2026-06-03 08:33:16 +0900

esi_clean.pdf
Multiobjective Solid Electrolyte Design of Tetragonal and Cubic Inverse-Perovskites for All-Solid-State Lithium-Ion Batteries by High-Throughput Density Functional Theory Calculations and AI-Driven Methods
ジャーナル論文
著者
JALEM Randy (author) (この著者で検索)
National Institute for Materials Science Research Center for Energy and Environmental Materials (GREEN)/Battery and Cell Materials Field/Interface Electrochemistry Group
ORCID SAMURAI ;
TATEYAMA Yoshitaka (author) (この著者で検索)
National Institute for Materials Science Research Center for Energy and Environmental Materials (GREEN)/Battery and Cell Materials Field/Interface Electrochemistry Group
ORCID SAMURAI ;
TAKADA Kazunori (author) (この著者で検索)
National Institute for Materials Science Research Center for Energy and Environmental Materials (GREEN)/Battery and Cell Materials Field/Solid-State Battery Group
ORCID SAMURAI ;
JANG Seonghoon (author) (この著者で検索)
National Institute for Materials Science Research Center for Energy and Environmental Materials (GREEN)/Battery and Cell Materials Field/Interface Electrochemistry Group
キーワード
all solid state batteries, solid electrolytes, density functional theory, materials informatics, machine learning, novel materials search
刊行年月日
2023-09-07
更新時刻
2024-08-28 08:30:15 +0900

Togo_2023_J._Phys.__Condens._Matter_35_353001.pdf
Implementation strategies in phonopy and phono3py
ジャーナル論文
著者
Atsushi Togo (author) (この著者で検索)
ORCID SAMURAI ;
Laurent Chaput (author) (この著者で検索)
;
Terumasa Tadano (author) (この著者で検索)
ORCID SAMURAI ;
Isao Tanaka (author) (この著者で検索)
キーワード
Phonon calculation
刊行年月日
2023-09-04
更新時刻
2024-01-05 22:11:26 +0900

ChemPlusChem25_90_e202500342.pdf
Machine Learning—Guided Design of Biomass‐Based Porous Carbon for Aqueous Symmetric Supercapacitors
ジャーナル論文
著者
Manickam Minakshi (author) (この著者で検索)
ORCID ;
Apsana Sharma (author) (この著者で検索)
;
Ferdous Sohel (author) (この著者で検索)
;
Almantas Pivrikas (author) (この著者で検索)
ORCID ;
Pragati A. Shinde (author) (この著者で検索)
ORCID ; ORCID SAMURAI ; ORCID SAMURAI
キーワード
biomass, carbon, dopant, energy, machine learning, storage
刊行年月日
2025-10-09
更新時刻
2025-10-21 16:06:10 +0900

2024A00489G_Negative_compressibility_of_charge_islands_within_twisted_bilayer_graphene_main.pdf
Negative electronic compressibility in charge islands in twisted bilayer graphene
ジャーナル論文
著者
Robin J. Dolleman (author) (この著者で検索)
;
Alexander Rothstein (author) (この著者で検索)
;
Ammon Fischer (author) (この著者で検索)
;
Lennart Klebl (author) (この著者で検索)
;
Lutz Waldecker (author) (この著者で検索)
;
Kenji Watanabe (author) (この著者で検索)
ORCID SAMURAI ;
Takashi Taniguchi (author) (この著者で検索)
ORCID SAMURAI ;
Dante M. Kennes (author) (この著者で検索)
;
Florian Libisch (author) (この著者で検索)
;
Bernd Beschoten (author) (この著者で検索)
;
Christoph Stampfer (author) (この著者で検索)
キーワード
twisted bilayer graphene, negative electronic compressibility, Wigner crystallization
刊行年月日
2024-04-23
更新時刻
2025-09-17 12:30:26 +0900