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Improved quantum sampling methods for molecular simulations

van Rossum, Connor et al.
arXiv (All) · Papers
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chemical-physicscomputational-physicsquantum-physics
Quantum-selected configuration interaction (QSCI) methods use a quantum computer to identify dominant electronic configurations in the molecular ground state, while a classical computer diagonalizes the Hamiltonian within the reduced subspace spanned by those configurations. Sample-based quantum dia
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