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Hydrogen chain Hamiltonians

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Zenodo2025-07-30 更新2026-05-26 收录
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Hamiltonians of hydrogen chains in a STO-3G basis, decomposed in terms of Pauli strings, used in one of the benchmark protocols defined in the AppQSim benchmarking suite available at https://arxiv.org/abs/2503.04298. The identity term has been removed from the decomposition, and a term proportional to (\sum_j Z_j)^2 (which commutes with the Hamiltonian) has been added to each Hamiltonian, so as to minimize the sum of the absolute value of the coefficients.

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2025-07-30
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