openqemist.problem_decomposition package

Subpackages

• openqemist.problem_decomposition.dmet package
  • Submodules
  • openqemist.problem_decomposition.dmet.dmet_problem_decomposition module
  • Module contents
• openqemist.problem_decomposition.electron_localization package
  • Submodules
  • openqemist.problem_decomposition.electron_localization.iao_localization module
  • openqemist.problem_decomposition.electron_localization.meta_lowdin_localization module
  • Module contents

Submodules

openqemist.problem_decomposition.problem_decomposition module

class openqemist.problem_decomposition.problem_decomposition.ProblemDecomposition

Bases: abc.ABC

abstract simulate(molecule, fragment_atoms, mean_field=None)

Module contents