qrunch.chemistry.ground_state_problem.calculators

Module containing calculators for solving ground state problems.

Modules

calculators_protocols

Protocol class for the ground state calculators.

configuration_interaction_ground_state_problem_calculators

Ground state energy calculator using configuration interaction (CI).

pair_configuration_interaction_calculators

Ground state energy calculator using Pair Full CI.

tools

Tools used in ground state problem calculators.

vqe_creator

Module containing all the VQE (Variational Quantum Eigensolver) algorithms with chemistry-tailored defaults.

vqe_ground_state_problem_calculator

Classes for calculating the ground state energy of a molecule using a VQE algorithm.