OpenFermion Hamiltonian

SkillDev tools

Molecular Hamiltonian construction skill using OpenFermion

Instructions available. Your AI can read the instructions. Execution depends on the setup they require.

Add ahel to your AI once: Claude, ChatGPT, Cursor, Claude Code or Codex. Then ask it to use this.

Then ask your AI: use the OpenFermion Hamiltonian skill

What this skill tells your AI

The instructions your AI receives, as published by a5c-ai/babysitter in library/specializations/domains/science/quantum-computing/skills/openfermion-hamiltonian/SKILL.md and read by ahel’s review.

Purpose

Provides expert guidance on molecular Hamiltonian construction and fermion-to-qubit mappings using OpenFermion for quantum chemistry applications.

Capabilities

  • Molecular Hamiltonian generation
  • Jordan-Wigner transformation
  • Bravyi-Kitaev transformation
  • Parity transformation
  • Second quantization handling
  • Symmetry reduction
  • Active space selection
  • Hamiltonian term grouping

Usage Guidelines

  1. Molecular Setup: Define molecular geometry and basis set
  2. Hamiltonian Generation: Compute molecular integrals and construct Hamiltonian
  3. Transformation Selection: Choose appropriate fermion-to-qubit mapping
  4. Qubit Reduction: Apply symmetry and active space reductions
  5. Term Analysis: Analyze Hamiltonian structure for circuit design

Tools/Libraries

  • OpenFermion
  • OpenFermion-PySCF
  • OpenFermion-Psi4
  • Qiskit Nature
  • PennyLane

Signals

GitHub stars
2k
Forks
112
Last commit
Sep 2026
Advanced
Item type
skill
Key
openfermion-hamiltonian
Source
github.com/a5c-ai/babysitter