論文・データセット - MDR: NIMS Materials Data Repository

資源タイプ: journal_article キーワード: solid electrolytes

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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

論文
著者: Randy Jalem ; Yoshitaka Tateyama ; Kazunori Takada ; Tetsuya Yamada ; Katsuya Teshima
キーワード: 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
刊行年月日: 2025-10-01
更新時刻: 2025-12-19 08:30:58 +0900

LLNOF_es1_rev_v3.pdf

Crystal structure, stability and Li superionic conductivity of pyrochlore-type solid electrolyte Li_2−xLa_(1+x)/3Nb₂O₆F: a first-principles calculation study

論文
著者: Randy Jalem ; Kazunori Takada ; Hitoshi Onodera ; Shuhei Yoshida
キーワード: all solid state batteries, solid electrolytes, first-principles calculation, molecular dynamics simulations
刊行年月日: 2024-10-28
更新時刻: 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

論文
著者: Seong-Hoon Jang ; Randy Jalem ; Yoshitaka Tateyama
キーワード: all solid state batteries, solid electrolytes, high-throughput first-principles calculation, computational materials search, machine learning, sodium ion conductors
刊行年月日: 2024-08-05
更新時刻: 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

論文
著者: JALEM Randy ; TATEYAMA Yoshitaka ; TAKADA Kazunori ; JANG Seonghoon
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