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CSM及TET，CS

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koko
2025-12-14 12:57:34 +08:00
parent cea5ab6d3f
commit da26e0c619
11 changed files with 230 additions and 6 deletions
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py/csm.py
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@@ -12,11 +12,11 @@ from tqdm import tqdm
# ================= 配置区域 =================
# 输入目录：使用筛选后的目录，只计算符合要求的材料
INPUT_DIR = "../data/after_screening"
INPUT_DIR = "../../solidstate-tools/corner-sharing/data/1209/input"
# 输出目录
OUTPUT_DIR = "../output/CSM"
# 分析参数
TARGET_ELEMENT = 'Li'
TARGET_ELEMENT = 'Na'
ENV_TYPE = 'both' # 可选 'tet', 'oct', 'both'
# ===========================================