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  • DP Technology
  • Beijing, China

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Azhi-ss/README.md
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A researcher bridging AI and Materials Science ⚛️🎓


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🔬 Research & Interests

  • 🧬 Materials Science: Polymer Physics, Computational Chemistry, Molecular Dynamics
  • 🤖 AI & Simulation: Large Language Models (LLMs), AI Agents, AI for Science (AI4S)

⚙️ Key Projects

  • 🧬 mamba2poly - Polymer property prediction based on Mamba architecture.
  • 🤖 Azhi_agents - A powerful and versatile AI agents aggregation and automation framework.
  • ⚡ autoscf - An automated workflow designed to accelerate Self-Consistent Field (SCF) calculations in computational chemistry.

💻 Tech Stack & Tools

🧬 Computational Chemistry
GROMACS Gaussian VASP LAMMPS


🧠 AI & Data Science
Python PyTorch TensorFlow scikit-learn MATLAB R


⚙️ Architecture & Databases
Linux Docker MySQL MongoDB Redis Git


"Simulating the future of materials, one atom at a time."

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