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MCP server for wave mechanics and Schrodinger equation simulations

Project description

scicomp-quantum-mcp

MCP server for wave mechanics and Schrödinger equation simulations.

Overview

This server provides tools for quantum mechanics simulations and wavefunction analysis:

  • Schrödinger solver - Time-dependent wave equation simulations in 1D and 2D
  • Potential creation - Crystalline lattices, custom potentials, harmonic oscillators
  • Wavefunction analysis - Observable computation, probability density, energy analysis
  • Wave packets - Gaussian wave packet creation and evolution
  • GPU acceleration - Optional CUDA acceleration for large simulations

Installation & Usage

# Run directly with uvx (no installation required)
uvx scicomp-quantum-mcp

# Or install with pip
pip install scicomp-quantum-mcp

# With GPU support
pip install scicomp-quantum-mcp[gpu]

# Run as command
scicomp-quantum-mcp

Available Tools

Potential Creation

  • create_lattice_potential - Crystalline lattice potentials (square, hexagonal, triangular)
  • create_custom_potential - Custom potential from mathematical function
  • create_gaussian_wavepacket - Localized Gaussian wave packets
  • create_plane_wave - Plane wave states

Simulation

  • solve_schrodinger - 1D time-dependent Schrödinger equation
  • solve_schrodinger_2d - 2D time-dependent Schrödinger equation
  • get_task_status - Monitor async simulations
  • get_simulation_result - Retrieve completed simulation data

Analysis

  • analyze_wavefunction - Compute observables from wavefunction
  • visualize_potential - Plot potential energy landscapes
  • render_video - Animate probability density evolution

Configuration

Enable GPU acceleration with environment variable:

MCP_USE_GPU=1 scicomp-quantum-mcp

Examples

See the API documentation for detailed examples and simulations.

Part of Math-Physics-ML MCP System

Part of a comprehensive system for scientific computing. See the documentation for the complete ecosystem.

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