mlsanityData to 14 Oct 2026

Efficient anti-symmetrization of a neural network layer by taming the sign problem

arXiv 2205.12250 ↗First posted 24 May 2022cs.LG cs.NA math.NAcited by 0

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Abstract (arXiv)

Explicit antisymmetrization of a neural network is a potential candidate for a universal function approximator for generic antisymmetric functions, which are ubiquitous in quantum physics. However, this procedure is a priori factorially costly to implement, making it impractical for large numbers of particles. The strategy also suffers from a sign problem. Namely, due to near-exact cancellation of positive and negative contributions, the magnitude of the antisymmetrized function may be significantly smaller than before anti-symmetrization. We show that the anti-symmetric projection of a two-layer neural network can be evaluated efficiently, opening the door to using a generic antisymmetric layer as a building block in anti-symmetric neural network Ansatzes. This approximation is effective when the sign problem is controlled, and we show that this property depends crucially the choice of activation function under standard Xavier/He initialization methods. As a consequence, using a smooth activation function requires re-scaling of the neural network weights compared to standard initializations.

Key facts. No citing papers in the map yet (data through 14 Oct 2026). Builds on 8 of its 17 references that are in the map. First posted on arXiv 24 May 2022.

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References · 8

  1. 2017Deep Setscited by 1,421
  2. 2017A simple neural network module for relational reasoningcited by 346
  3. 2019Ab-Initio Solution of the Many-Electron Schr"odinger Equation with Deep Neural Networkscited by 200
  4. 2018Universal approximations of invariant maps by neural networkscited by 127
  5. 2019Deep neural network solution of the electronic Schr"odinger equationcited by 127
  6. 2020A Functional Perspective on Learning Symmetric Functions with Neural Networkscited by 17
  7. 2020Phases of two-dimensional spinless lattice fermions with first-quantized deep neural-network quantum statescited by 15
  8. 2021Explicitly antisymmetrized neural network layers for variational Monte Carlo simulationcited by 14

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