Keyword: solid electrolytes
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5 records found.

manuscript_LZON_rev1_clean.pdf
First‐Principles Study on the Interfacial Cathode‐Contact Stability and Li Diffusivity of N‐Doped Li 6 Zr 2 O 7 for All‐Solid‐State Li‐Ion Batteries
Journal article
Creator
ORCID SAMURAI ; ORCID SAMURAI ; ORCID SAMURAI ;
Tetsuya Yamada (author) (Search by this author)
;
Katsuya Teshima (author) (Search by this author)
Keyword
all solid state batteries, lithium ion conductors, solid electrolytes, cathode coatings, first-principles calculations, molecular dynamics simulations, machine learning interatomic potentials, solid hetero-interface modeling
Date published
2025-10-01
Updated at
2025-12-19 08:30:58 +0900
TSTM-2025-0032.R1_graphical_abstract.pdf
Designing a Unified Data Structure for Solid-Electrolyte Research Projects
Dataset
Creator
Yasuhiro Fujiwara (author) (Search by this author)
Research Network and Facility Services Division/Materials Data Platform/Data Application Unit, National Institute for Materials Science
ORCID SAMURAI ;
Masahiko Demura (author) (Search by this author)
Research Network and Facility Services Division, National Institute for Materials Science
ORCID SAMURAI ;
Kazunori Takada (author) (Search by this author)
Research Center for Energy and Environmental Materials (GREEN)/Battery and Cell Materials Field/Solid-State Battery Group, National Institute for Materials Science
ORCID SAMURAI ;
Kota Suzuki (author) (Search by this author)
Institute of Science Tokyo
;
Satoshi Hori (author) (Search by this author)
Institute of Science Tokyo
;
Masaki Azuma (author) (Search by this author)
Institute of Science Tokyo
;
Ryoji Kanno (author) (Search by this author)
Institute of Science Tokyo
;
Yoshiyuki Inaguma (author) (Search by this author)
Gakushuin University
;
Akitoshi Hayashi (author) (Search by this author)
Osaka Metropolitan University
;
Yasutoshi Iriyama (author) (Search by this author)
Graduate School of Engineering, Nagoya University
;
Hirotoshi Yamada (author) (Search by this author)
Nagasaki University
;
Tetsuhiro Katsumata (author) (Search by this author)
Tokai University
Keyword
process chain, data structure, data model, data management, Research Data Express, RDE, solid electrolytes
Date published
2025-12-31
Updated at
2025-12-19 08:30:30 +0900
LLNOF_es1_rev_v3.pdf
Crystal structure, stability and Li superionic conductivity of pyrochlore-type solid electrolyte Li2−xLa(1+x)/3Nb2O6F: a first-principles calculation study
Journal article
Creator
Randy Jalem (author) (Search by this author)
National Institute for Materials Science
ORCID SAMURAI ;
Kazunori Takada (author) (Search by this author)
National Institute for Materials Science
ORCID SAMURAI ;
Hitoshi Onodera (author) (Search by this author)
;
Shuhei Yoshida (author) (Search by this author)
Keyword
all solid state batteries, solid electrolytes, first-principles calculation, molecular dynamics simulations
Date published
2024-10-28
Updated at
2025-10-28 08:30:19 +0900
jmca2024_NaSulfideConductor_esi_rj.pdf
Computational discovery of stable Na-ion sulfide solid electrolytes with high conductivity at room temperature
Journal article
Creator
Seong-Hoon Jang (author) (Search by this author)
ORCID ;
Randy Jalem (author) (Search by this author)
National Institute for Materials Science
ORCID SAMURAI ;
Yoshitaka Tateyama (author) (Search by this author)
National Institute for Materials Science
ORCID SAMURAI
Keyword
all solid state batteries, solid electrolytes, high-throughput first-principles calculation, computational materials search, machine learning, sodium ion conductors
Date published
2024-08-05
Updated at
2024-10-10 16:30:52 +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
Journal article
Creator
JALEM Randy (author) (Search by this author)
Research Center for Energy and Environmental Materials (GREEN)/Battery and Cell Materials Field/Interface Electrochemistry Group, National Institute for Materials Science
ORCID SAMURAI ;
TATEYAMA Yoshitaka (author) (Search by this author)
Research Center for Energy and Environmental Materials (GREEN)/Battery and Cell Materials Field/Interface Electrochemistry Group, National Institute for Materials Science
ORCID SAMURAI ;
TAKADA Kazunori (author) (Search by this author)
Research Center for Energy and Environmental Materials (GREEN)/Battery and Cell Materials Field/Solid-State Battery Group, National Institute for Materials Science
ORCID SAMURAI ;
JANG Seonghoon (author) (Search by this author)
Research Center for Energy and Environmental Materials (GREEN)/Battery and Cell Materials Field/Interface Electrochemistry Group, National Institute for Materials Science
Keyword
all solid state batteries, solid electrolytes, density functional theory, materials informatics, machine learning, novel materials search
Date published
2023-09-07
Updated at
2024-08-28 08:30:15 +0900