most citedSPAM(a,b): encoding the density information from guess Hamiltonian in quantum machine learning representations

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physics.chem-ph2023★ 10 cited

SPAM(a,b): encoding the density information from guess Hamiltonian in quantum machine learning representations

Ksenia R. Briling, Yannick Calvino Alonso, Alberto Fabrizio +1

Recently, we introduced a class of molecular representations for kernel-based regression methods -- the spectrum of approximated Hamiltonian matrices (SPAM) -- that ta…