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SHARC-VQE: Simplified Hamiltonian Approach with Refinement and Correction enabled Variational Quantum Eigensolver for Molecular Simulation

SHARC-VQE: Simplified Hamiltonian Approach with Refinement and Correction enabled Variational Quantum Eigensolver for Molecular Simulation

The transformation of a molecular Hamiltonian from the fermionic space to the qubit space results in a series of Pauli strings. Calculating the energy then involves evaluating the expectation values of each of these strings, which presents a significant bottleneck for applying variational quantum eigensolvers (VQEs) in quantum chemistry. Unlike …