Chern-Number

Chern-Number is a code for calculating the Chern number, a topological invariant, using the discretized Berry curvature on a grid. It post-processes output from Wannier90 or tight-binding models to determine the topological character of…

8. POST-PROCESSING 8.2 Topological & Symmetry Analysis VERIFIED
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Overview

Chern-Number is a code for calculating the Chern number, a topological invariant, using the discretized Berry curvature on a grid. It post-processes output from Wannier90 or tight-binding models to determine the topological character of 2D band structures and detect topological phase transitions.

Reference Papers

Reference papers are not yet linked for this code.

Full Documentation

Official Resources

  • Homepage: https://github.com/stepan-tsirkin/chern-number
  • GitHub: https://github.com/stepan-tsirkin/chern-number
  • Developer: Stepan Tsirkin (University of Zurich)
  • License: Check repository

Overview

Chern-Number is a code for calculating the Chern number, a topological invariant, using the discretized Berry curvature on a grid. It post-processes output from Wannier90 or tight-binding models to determine the topological character of 2D band structures and detect topological phase transitions.

Scientific domain: Topological band theory, Chern insulators, quantum anomalous Hall effect Target user community: Researchers studying topological phases of matter and Chern insulators

Theoretical Methods

  • Berry curvature calculation on k-space grid
  • Discretized Brillouin zone integration
  • Fukui-Hatsugai-Suzuki method
  • Link variable approach for gauge invariance
  • Wannier function interpolation

Capabilities (CRITICAL)

  • Berry Curvature: Calculation across the Brillouin zone
  • Chern Number: Grid-based integration method
  • Metallic Systems: Handles partially filled bands
  • Phase Transitions: Detection of topological transitions
  • Wannier90 Interface: Direct _hr.dat file support
  • Tight-Binding: Model Hamiltonian compatibility

Sources: GitHub repository, developer documentation

Key Strengths

Robust Integration:

  • Grid-based method
  • Gauge-invariant formulation
  • Convergence with k-points
  • Accurate for complex bands

Wannier90 Compatible:

  • Direct interface with Wannier90
  • Uses interpolated bands
  • Efficient k-point sampling
  • Standard file formats

Developer Ecosystem:

  • Part of IrRep/WannierBerri ecosystem
  • Consistent methodology
  • Active maintenance
  • Research-grade code

Inputs & Outputs

  • Input formats:

    • Wannier90 _hr.dat files
    • Tight-binding model parameters
    • k-mesh specification
  • Output data types:

    • Chern numbers per band
    • Berry curvature maps
    • Band-resolved invariants

Installation

git clone https://github.com/stepan-tsirkin/chern-number.git
cd chern-number
# Follow installation instructions

Usage Examples

# Example usage
from chern import ChernCalculator

# Load Wannier90 Hamiltonian
calc = ChernCalculator.from_wannier90("wannier90_hr.dat")

# Calculate Chern number for occupied bands
chern = calc.compute_chern(nk=100, bands=range(4))
print(f"Chern number: {chern}")

Performance Characteristics

  • Speed: Efficient grid-based calculation
  • Accuracy: Convergent with k-mesh density
  • Memory: Moderate for typical systems

Limitations & Known Constraints

  • 2D systems: Primarily for 2D or quasi-2D systems
  • Band gaps: Best for gapped systems
  • Convergence: Requires sufficient k-points
  • Learning curve: Topological band theory knowledge needed

Comparison with Other Tools

  • vs Z2Pack: Chern-Number grid-based, Z2Pack WCC-based
  • vs WannierBerri: Chern-Number specialized, WannierBerri comprehensive
  • vs WannierTools: Different calculation approaches
  • Unique strength: Simple, focused Chern number calculation

Application Areas

  • Quantum anomalous Hall effect
  • Chern insulator identification
  • Topological phase diagrams
  • Magnetic topological materials
  • 2D material topology

Best Practices

  • Use converged Wannier90 calculations
  • Check Chern number convergence with k-mesh
  • Verify gap remains open
  • Compare with symmetry indicators

Community and Support

  • GitHub repository
  • Developer: Stepan Tsirkin
  • Related to IrRep ecosystem
  • Research code with academic support

Verification & Sources

Primary sources:

  1. GitHub: https://github.com/stepan-tsirkin/chern-number
  2. Developer: Stepan Tsirkin (University of Zurich)
  3. Related tools: IrRep, WannierBerri

Confidence: VERIFIED

Verification status: ✅ VERIFIED

  • GitHub repository: ACCESSIBLE
  • Source code: OPEN
  • Developer: Active researcher
  • Method: Berry curvature integration

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