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Predicting fermionic densities using a Projected Quantum Kernel method

arXiv 2504.14002 ↗First posted 18 Apr 2025quant-ph cond-mat.str-el cs.LGcited by 0

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Abstract (arXiv)

We use a support vector regressor based on a projected quantum kernel method to predict the density structure of 1D fermionic systems of interest in quantum chemistry and quantum matter. The kernel is built on with the observables of a quantum reservoir implementable with interacting Rydberg atoms. Training and test data of the fermionic system are generated using a Density Functional Theory approach. We test the performance of the method for several Hamiltonian parameters, finding a general common behavior of the error as a function of measurement time. At sufficiently large measurement times, we find that the method outperforms the classical linear kernel method and can be competitive with the radial basis function method.

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References · 7

  1. 2020Power of data in quantum machine learningcited by 338
  2. 2016Quantum Machine Learningcited by 326
  3. 2016By-passing the Kohn-Sham equations with machine learningcited by 67
  4. 2021Quantum machine learning of large datasets using randomized measurementscited by 30
  5. 2024Quantum Kernel Methods under Scrutiny: A Benchmarking Studycited by 22
  6. 2013Orbital-free Bond Breaking via Machine Learningcited by 8
  7. 2014Understanding Machine-learned Density Functionalscited by 8

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