In this work, we introduce a complementary optimization method for progressive and adaptive state search (COMPASS) based on biorthogonal adaptive recurrent neural quantum states. Our approach combines an adaptive autoregressive architecture with a biorthogonal variational Monte Carlo scheme as well as a complementary optimization scheme that alternates between energy and variance minimization. This enables the stable convergence to ground-state eigenpairs, while avoiding Markov chain sampling through exact autoregressive generation. We demonstrate that for parity-time(PT)-symmetric Hamiltonians, unconstrained complex ansatze can spontaneously break PT symmetry during optimization, even in the unbroken phase, leading to spurious imaginary energies. Real-valued ansatze, on the other hand, naturally constrain the optimization to the correct physical manifold. Conversely, for generic non-Hermitian (NH) Hamiltonians without symmetry protection and complex spectra, complex ansatze are essential for capturing complex ground-state properties. Our results establish that physically-informed ansatz selection is crucial for reliable NH simulations. By combining adaptive architectures, biorthogonal optimization, and symmetry-aware modeling, this framework enables a direct study of 1D and 2D NH many-body systems without Hermitian embeddings or adiabatic continuation. Applying this framework to systems with frustrated magnetism, we show that gap frustration provides a quantitative shield against NH spectral instability, with the frustration gap setting a critical threshold for PT-symmetry breaking. Also, complexifying the frustration coupling itself generates a new topologically nontrivial network of diabolic level crossings, controlled by the phase of the complex coupling, that has no Hermitian analog. We term this novel spectral topology in NH frustrated systems the diabolic ring.
Lavoisier Wah, Flore K. Kunst, Mohamed Hibat-Allah· 3 citations· ⚡1
Neural Quantum States (NQS) provide a powerful neural network-based variational framework for representing many-body wave functions and solving for ground states. Recurrent Neural Networks (RNNs) are particularly promising owing to their relatively low computational cost and their autoregressive property, which enables perfect sampling. Recently, RNNs have been reported to be unstable under curvature-based optimizers such as the minimum-step stochastic reconfiguration (minSR) method. In this paper, we address this perceived limitation and show that minSR can be stabilized through simple regularization techniques, enabling robust training of RNN-based NQS with only a few samples. Our approach outperforms the Adam optimizer on the one-dimensional transverse-field Ising model and the one-dimensional cluster state, and provides competitive results on the two-dimensional Heisenberg and $J_1-J_2$ models. This work offers a promising pathway for using modern optimization techniques with autoregressive NQS to address open questions in quantum simulation.
Adi Attar, A. M. Aboussalah, Mohamed Hibat-Allah· 0 citations