Welcome to pyatb_quick_start’s documentation!

Quick Start

• Introduction
  • Capabilities
  • Methodology
  • Workflow
• Installation
  • Install via PyPI
  • Install from Source
• Run
• Brief introduction of the input files
  • Input
  • HR, SR, rR
  • Other file

Functions

• Functions
  • BAND_STRUCTURE
  • BANDUNFOLDING
  • FERMI_ENERGY
  • FERMI_SURFACE
  • FIND_NODES
  • PDOS
  • FAT_BAND
  • SPIN_TEXTURE
  • WILSON_LOOP
  • POLARIZATION
  • BERRY_CURVATURE
  • AHC
  • CHERN_NUMBER
  • CHIRALITY
  • JDOS
  • OPTICAL_CONDUCTIVITY
  • SHIFT_CURRENT
  • BERRY_CURVATURE_DIPOLE
  • SECOND_HARMONIC_GENERATION

Keywords

• Detailed Introduction of the Input Files
  • Full List of INPUT Keywords
  • Setting of k points
  • Setting of integration