"author:PhelanShao" matching MCP servers:

• abacus-mcp-server

  PhelanShao

  A

  license

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  quality

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  maintenance

  Enables AI-driven first-principles calculations for quantum chemistry and materials science using ABACUS, with tools for SCF, structure optimization, molecular dynamics, band structure, and intelligent parameter suggestions.

  Last updated 2025-05-30

  9

  GPL 3.0