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Pauli Decomposition via the Fast Walsh-Hadamard Transform v2

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Zenodo2025-02-21 更新2026-05-26 收录
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资源简介:

scirpt and data used to produce results for the paper "Pauli Decomposition via the Fast Walsh-Hadamard Transform" (https://arxiv.org/abs/2408.06206). In this second version, we uploaded scripts for two new tests: calcualtion of kinetic energy matrix (kinetic_energy_matrix.zip) and electron repulsion integrals (fe2s2.zip). All other files are the same as in version no. 1.

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Zenodo
创建时间:
2025-01-27
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