qrunch.chemistry.calculators.tools.initial_ansatz

Module containing initial ansatzes to be used in calculations.

Modules

electron_pair_hartree_fock

Module designed to generate an initial state circuit that corresponds to a paired Hartree-Fock wave function.

hartree_fock

Module designed to generate an initial state circuit that corresponds to a Hartree-Fock wave function.

initial_ansatz_protocols

Interface for defining an initial wave-function ansatz (Usually a Hartree-Fock state) for a molecule.

initial_ansatz_sub_creator

Sub-creator for choosing an initial ansatz builder on a parent creator.

moller_plesset_circuit

Module designed to generate an initial state circuit that corresponds to a MP2 wave function.

state_prep

Module designed to generate an initial state circuit that corresponds to a MP2 wave function.