Skip to content

Commit

Permalink
Update GPUMD&NEP_06_12_2024.md
Browse files Browse the repository at this point in the history
  • Loading branch information
RussellHu41 authored Dec 23, 2024
1 parent 6a8b7e9 commit 80ae12d
Showing 1 changed file with 2 additions and 0 deletions.
2 changes: 2 additions & 0 deletions source/_posts/GPUMD&NEP_06_12_2024.md
Original file line number Diff line number Diff line change
Expand Up @@ -9,6 +9,8 @@ GPUMD is an efficient domestic molecular dynamics simulation software developed

In June 2024, GPUMD&NEP joined the DeepModeling community. As an innovative and highly efficient MD simulation and machine learning potential function tool, it further provides support for the Materials Genome Project and the AI4S community.

<!-- more -->

## Introduction

In recent years, all-solid-state lithium-ion batteries have attracted much attention due to their high safety and high energy density. As a solid-state electrolyte material with high ionic conductivity and stability, Li7La3Zr2O12 (LLZO) is particularly remarkable. However, there is a significant difference between the theoretically predicted activation energy (about 1.2 eV) and the experimentally measured value (about 0.45 eV) for lithium-ion migration in the tetragonal phase LLZO. This contradiction limits the in-depth understanding and optimization of the material's performance.
Expand Down

0 comments on commit 80ae12d

Please sign in to comment.