Corrosion Engineering MCP Server

# ============================================================================ # Corrosion Engineering MCP Server - Dependencies # ============================================================================ # # This file specifies all Python dependencies for the corrosion engineering # MCP server, organized by phase and purpose. # # Installation: # - Uses parent directory venv312: ../venv312/ # - Install with: pip install -r requirements.txt # # Note: Can reuse venv312 from parent directory for consistency with # sister MCPs (degasser-design-mcp, water-chemistry-mcp, etc.) # # ============================================================================ # ---------------------------------------------------------------------------- # MCP Framework (Required - All Phases) # ---------------------------------------------------------------------------- fastmcp>=0.1.0 # FastMCP framework for MCP server implementation # ---------------------------------------------------------------------------- # Core Scientific Computing (Required - All Phases) # ---------------------------------------------------------------------------- numpy>=1.24.0 # Numerical arrays and mathematical operations scipy>=1.10.0 # Scientific algorithms (integration, optimization) pandas>=2.0.0 # Data manipulation and analysis pydantic>=2.0.0 # Data validation and settings management fluids>=1.2.0 # Fluid mechanics utilities (Re, Sc, Sh calculations) ht>=1.0.0 # Heat transfer correlations (Nu → Sh via analogy) # ---------------------------------------------------------------------------- # Chemistry Engines (Phase 1+) # ---------------------------------------------------------------------------- phreeqpython>=1.5.5 # PHREEQC wrapper for aqueous chemistry speciation # Chosen over IPhreeqcPy for ecosystem consistency # with degasser-design-mcp and water-chemistry-mcp # pymatgen>=2023.0.0 # Phase 2 - Pourbaix diagram generation # Uncomment when implementing Phase 2 # pycalphad>=0.10.0 # Phase 5 (Future) - CALPHAD thermodynamics # For high-temperature phases beyond PHREEQC scope # ---------------------------------------------------------------------------- # Electrochemistry & Materials Science (Phase 2-3) # ---------------------------------------------------------------------------- # impedance>=1.5.0 # Phase 2 - EIS fitting, polarization curve analysis # For galvanic corrosion and cathodic protection # matminer>=0.9.0 # Phase 3 - Materials feature extraction # For alloy properties, PREN calculation, CPT estimation # ---------------------------------------------------------------------------- # Transport Phenomena (Phase 4) # ---------------------------------------------------------------------------- # openpnm>=3.0.0 # Phase 4 - Pore-network transport modeling # For advanced coating diffusion beyond Zargarnezhad # ---------------------------------------------------------------------------- # Psychrometrics (Phase 3) # ---------------------------------------------------------------------------- # PsychroLib>=2.5.0 # Phase 3 - Psychrometric calculations # For CUI wetness fraction and dew point # ---------------------------------------------------------------------------- # Uncertainty Quantification (Phase 4) # ---------------------------------------------------------------------------- # SALib>=1.4.0 # Phase 4 - Sensitivity analysis and sampling # Latin Hypercube, Sobol indices for Monte Carlo # scikit-learn>=1.3.0 # Phase 4 - Additional sampling methods # For variance reduction in Monte Carlo # ---------------------------------------------------------------------------- # Process Integration (Phase 5 - Future) # ---------------------------------------------------------------------------- # dwsimopt # Phase 5 - DWSIM automation # For process simulation integration # watertap>=0.11.0 # Phase 5 - WaterTAP integration # pyomo>=6.7.0 # Phase 5 - Required by WaterTAP # idaes-pse>=2.2.0 # Phase 5 - Required by WaterTAP # ---------------------------------------------------------------------------- # Data Loading & HTTP (Required - Phase 0+) # ---------------------------------------------------------------------------- requests>=2.31.0 # HTTP library for loading GitHub data sources # Used by AuthoritativeMaterialDatabase to fetch # USNRL galvanic series and KittyCAD properties requests-cache>=1.1.0 # HTTP response caching per Codex recommendation # Avoids repeated external calls on server restart lxml>=4.9.0 # XML parser for pandas.read_xml() # Required to load USNRL SeawaterPotentialData.xml # ---------------------------------------------------------------------------- # Utilities (Required - All Phases) # ---------------------------------------------------------------------------- python-dotenv>=1.0.0 # Environment variable management (.env files) pyyaml>=6.0 # YAML configuration file parsing # Used by coating_permeability_db.py and # electrochemistry_db.py for hybrid approach # ---------------------------------------------------------------------------- # Testing (Required - Development) # ---------------------------------------------------------------------------- pytest>=7.0.0 # Unit testing framework pytest-cov>=4.0.0 # Code coverage reporting pytest-asyncio>=0.21.0 # Async test support # ---------------------------------------------------------------------------- # Optional: Visualization # ---------------------------------------------------------------------------- # matplotlib>=3.7.0 # For plots (tornado diagrams, Pourbaix, etc.) # plotly>=5.0.0 # Interactive plots # ============================================================================ # Installation Notes # ============================================================================ # # Phase 0 (Current): # pip install fastmcp numpy scipy pandas pydantic python-dotenv pyyaml requests requests-cache lxml pytest pytest-cov pytest-asyncio # # Phase 1: # pip install phreeqpython>=1.5.5 # # Phase 2: # pip install pymatgen impedance # # Phase 3: # pip install PsychroLib matminer # # Phase 4: # pip install openpnm SALib scikit-learn # # Phase 5: # (Contact for DWSIM integration instructions) # # ============================================================================ # Version Compatibility # ============================================================================ # # Python Version: 3.12+ (uses venv312 from parent directory) # Tested with: Python 3.12.x # # Conflicts to Note: # - phreeqpython may require specific numpy/pandas versions # - pymatgen has heavy dependencies (may conflict with other packages) # - WaterTAP requires specific IDAES/Pyomo versions # # ============================================================================