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  • Installation
  • User Guide
  • API reference
  • Release notes
  • Contributor`s guide
  • How to cite us?
  • Support
  • Twitter
  • GitHub
  • PyPI

Section Navigation

Core elements

  • Cell
  • Lattice
    • wulfric.Lattice
      • wulfric.Lattice.copy
      • wulfric.Lattice.standardize
      • wulfric.Lattice.type
      • wulfric.Lattice.voronoi_cell
      • wulfric.Lattice.C_matrix
      • wulfric.Lattice.S_matrix
      • wulfric.Lattice.a
      • wulfric.Lattice.a1
      • wulfric.Lattice.a2
      • wulfric.Lattice.a3
      • wulfric.Lattice.alpha
      • wulfric.Lattice.angle_tol
      • wulfric.Lattice.b
      • wulfric.Lattice.b1
      • wulfric.Lattice.b2
      • wulfric.Lattice.b3
      • wulfric.Lattice.beta
      • wulfric.Lattice.c
      • wulfric.Lattice.cell
      • wulfric.Lattice.centring_type
      • wulfric.Lattice.conv_a
      • wulfric.Lattice.conv_a1
      • wulfric.Lattice.conv_a2
      • wulfric.Lattice.conv_a3
      • wulfric.Lattice.conv_alpha
      • wulfric.Lattice.conv_b
      • wulfric.Lattice.conv_beta
      • wulfric.Lattice.conv_c
      • wulfric.Lattice.conv_cell
      • wulfric.Lattice.conv_gamma
      • wulfric.Lattice.conv_parameters
      • wulfric.Lattice.conv_unit_cell_volume
      • wulfric.Lattice.convention
      • wulfric.Lattice.crystal_family
      • wulfric.Lattice.eps
      • wulfric.Lattice.eps_rel
      • wulfric.Lattice.gamma
      • wulfric.Lattice.k_a
      • wulfric.Lattice.k_alpha
      • wulfric.Lattice.k_b
      • wulfric.Lattice.k_beta
      • wulfric.Lattice.k_c
      • wulfric.Lattice.k_gamma
      • wulfric.Lattice.kpoints
      • wulfric.Lattice.name
      • wulfric.Lattice.parameters
      • wulfric.Lattice.pearson_symbol
      • wulfric.Lattice.rcell
      • wulfric.Lattice.reciprocal_cell
      • wulfric.Lattice.reciprocal_cell_volume
      • wulfric.Lattice.reciprocal_parameters
      • wulfric.Lattice.unit_cell_volume
      • wulfric.Lattice.variation
    • wulfric.Lattice.standardize
    • wulfric.Lattice.cell
    • wulfric.Lattice.a1
    • wulfric.Lattice.a2
    • wulfric.Lattice.a3
    • wulfric.Lattice.a
    • wulfric.Lattice.b
    • wulfric.Lattice.c
    • wulfric.Lattice.alpha
    • wulfric.Lattice.beta
    • wulfric.Lattice.gamma
    • wulfric.Lattice.unit_cell_volume
    • wulfric.Lattice.parameters
    • wulfric.Lattice.conv_cell
    • wulfric.Lattice.conv_a1
    • wulfric.Lattice.conv_a2
    • wulfric.Lattice.conv_a3
    • wulfric.Lattice.conv_a
    • wulfric.Lattice.conv_b
    • wulfric.Lattice.conv_c
    • wulfric.Lattice.conv_alpha
    • wulfric.Lattice.conv_beta
    • wulfric.Lattice.conv_gamma
    • wulfric.Lattice.conv_unit_cell_volume
    • wulfric.Lattice.conv_parameters
    • wulfric.Lattice.reciprocal_cell
    • wulfric.Lattice.rcell
    • wulfric.Lattice.b1
    • wulfric.Lattice.b2
    • wulfric.Lattice.b3
    • wulfric.Lattice.k_a
    • wulfric.Lattice.k_b
    • wulfric.Lattice.k_c
    • wulfric.Lattice.k_alpha
    • wulfric.Lattice.k_beta
    • wulfric.Lattice.k_gamma
    • wulfric.Lattice.reciprocal_cell_volume
    • wulfric.Lattice.reciprocal_parameters
    • wulfric.Lattice.kpoints
    • wulfric.Lattice.type
    • wulfric.Lattice.variation
    • wulfric.Lattice.name
    • wulfric.Lattice.pearson_symbol
    • wulfric.Lattice.centring_type
    • wulfric.Lattice.crystal_family
    • wulfric.Lattice.eps
    • wulfric.Lattice.eps_rel
    • wulfric.Lattice.angle_tol
    • wulfric.Lattice.copy
  • Bravais lattices
  • Kpoints
  • Atom
  • Crystal

Supplementary elements

  • identify
  • io
  • geometry
  • numerical
  • decorate
  • constants
  • exceptions

Plotting

  • PlotlyBackend
  • MatplotlibBackend
  • API reference
  • Lattice
  • wulfric.Lattice
  • wulfric.Lattice.C_matrix

wulfric.Lattice.C_matrix#

property

property Lattice.C_matrix#

Transformation matrix that transforms primitive cell (Lattice.cell()) to the conventional standardized cell.

See Conventional vs primitive cell (Setyawan and Curtarolo) for details.

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wulfric.Lattice.voronoi_cell

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wulfric.Lattice.S_matrix

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  • Lattice.C_matrix
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