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20182024
most citedAdaptive algorithm for electronic structure calculations using reduction of Gaussian mixtures

3 citations · 6 across the 7 of their papers we have counts for

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math.NA2018★ 3 cited

Adaptive algorithm for electronic structure calculations using reduction of Gaussian mixtures

Gregory Beylkin, Lucas Monzon, Xinshuo Yang

We present a new adaptive method for electronic structure calculations based on novel fast algorithms for reduction of multivariate mixtures. In our calculations, spatial orbitals…

math.NA2018★ 1 cited

Reduction of multivariate mixtures and its applications

Gregory Beylkin, Lucas Monzon, Xinshuo Yang

We consider fast deterministic algorithms to identify the "best" linearly independent terms in multivariate mixtures and use them to compute, up to a user-selected accuracy, an equ…