hdk：25.2.0
cann：8.3.RC1
python：3.11
torch：2.7.1
torch-npu：2.7.1

git clone https://atomgit.com/AI4Science/chgnet.git

1. 新建conda环境
conda create --name chgnet python=3.11
conda activate chgnet

2. 安装依赖
pip install chgnet
pip install pyyaml torch_npu==2.7.1 decorator attrs psutil absl-py cloudpickle ml-dtypes scipy tornado

python npu_test.py