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PETAL2D 0.1.0

  • Getting started
  • User guide
  • API reference
  • Guided examples
  • Validation and benchmarks
    • Theory
    • Development
  • Source
  • Getting started
  • User guide
  • API reference
  • Guided examples
  • Validation and benchmarks
  • Theory
  • Development
  • Source

Section Navigation

  • Example 1: isotropic QHO ground-state density
  • Example 2: a pure angular-momentum state
  • Example 3: controlled adaptive compression
  • Example 4: sampled numerical data
  • Example 5: real \(p_x\) and \(d_{x^2-y^2}\) orbitals
  • Example 6: a smooth \(C_3\)-symmetric localized field
  • Example 7: automatic centering
  • Guided examples

Guided examples#

The examples are ordered to build intuition from elementary angular structure to the numerical situations PETAL2D is intended to handle in practice.

  • Example 1: isotropic QHO ground-state density
  • Example 2: a pure angular-momentum state
  • Example 3: controlled adaptive compression
  • Example 4: sampled numerical data
  • Example 5: real \(p_x\) and \(d_{x^2-y^2}\) orbitals
  • Example 6: a smooth \(C_3\)-symmetric localized field
  • Example 7: automatic centering

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Scope and limitations

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Example 1: isotropic QHO ground-state density
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