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Table of Contents

  • pyfplo
  • Modules
  • Examples
    • A basic tutorial
    • 2D topological insulator
    • 3D topological insulator
    • Weyl semi metals
    • FEDIT scripting examples
    • FPLOIO examples

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A basic tutorial

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ExamplesΒΆ

  • A basic tutorial
    • The bulk band structure
    • The bulk Fermi surface
    • Fermi surface cuts
    • Bulk projected bands
    • Finite slab with 10 unit cells
    • Finite slab with 10 unit cells (doubled in-plane cell)
    • Finite slab with 10 unit cells (doubled in-plane cell), one atom removed
    • Finite slab with 10 unit cells (doubled in-plane cell), 3 atoms removed
    • Semi infinite slab
    • Semi infinite slab, doubled planar cell
  • 2D topological insulator
    • The topological phase
    • The trivial insulator phase
  • 3D topological insulator
  • Weyl semi metals
  • FEDIT scripting examples
    • Set bandplot points
    • Simple fedit example
    • BCC Iron
    • BCC and FCC Iron
    • Set Extended basis
    • BCC Iron, extended basis
    • mBJ XC-potential
  • FPLOIO examples
    • Reading =.in files
    • =.files to json
    • Reading cif-files
    • Write =.in with low level routines
    • Write =.in with mid level routines
    • Extract default basis into =.basdef
    • User defined basis (in =.basdef)
    • Extract =.basdef from output file
    • Grep results

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