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arXiv:2510.04164

Clifford Circuits Augmented Grassmann Matrix Product States

Atis Yosprakob, Tu, Wei-Lin, Tsuyoshi Okubo, Kouichi Okunishi, Donghoon Kim

Published Oct 5, 2025• 0 citations
arXivHTMLPDF

Abstract

Recent progress in combining Clifford circuits with tensor-network (TN) methods has shown that local Clifford disentanglers can reduce bipartite entanglement across TN bonds prior to tensor compression, thereby improving the efficiency of TN simulations. In this work, we embed local Clifford disentanglers in the Grassmann-tensor language to define a Clifford-augmented Grassmann matrix product state (CAGMPS) ansatz, and develop a density-matrix renormalization group (DMRG) framework based on this ansatz while preserving locality and fermion-parity structure. We benchmark the resulting CAGMPS--DMRG method on representative fermionic lattice systems, including the tight-binding, $t$-$V$, and $t$-$V$-$V'$ models. In all cases, Clifford augmentation systematically suppresses bipartite entanglement and improves the accuracy of the ground-state energy at a fixed bond dimension. We further show that the Grassmann-evenness condition, together with equivalence under entangling action, restricts the relevant two-site Clifford candidates to 12 inequivalent representatives, enabling a more economical disentangling search than approaches based on the standard two-qubit Clifford gate set. Our results suggest that the CAGMPS--DMRG method provides a scalable and efficient variational tool for strongly correlated fermionic systems.

DOI
10.48550/arxiv.2510.04164

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Entanglement is a key bottleneck limiting the efficiency of tensor-network and quantum simulations of molecular electronic structures. Here, we systematically assess and extend Clifford disentanglers as a structure-preserving approach to entanglement reduction: they can modify the entanglement structure of qubit wavefunctions while retaining the Pauli-string form of qubit Hamiltonians. To enable a practical search over Clifford transformations, we classify Clifford operators by their action on the Schmidt spectrum across a bipartition, reducing the two- and four-qubit search spaces to 20 and 91392 representatives, respectively. Embedded in an iterative Clifford-augmented matrix product state framework, these transformations reduce the energy errors at fixed bond dimension for the molecular test cases studied and mitigate the dependence on orbital orderings and fermion-to-qubit mappings. We further show that Clifford disentanglers can also benefit quantum simulations such as the shallow-circuit variational quantum eigensolver calculations. Together, these results establish Clifford disentanglers as a useful structure-preserving entanglement-engineering tool for tensor-network and quantum simulations of molecular electronic structure, while also clarifying their correlation dependence and motivating future developments.
Abstract Matchgates and Clifford circuits are two types of quantum circuits which can be efficiently simulated classically, though the underlying reasons are quite different. Matchgates are essentially the single particle basis transformations in the Majorana fermion representation, which can be easily handled classically, while the Clifford circuits can be efficiently simulated using the tableau method according to the Gottesman–Knill theorem. In this work, we propose a new wave-function ansatz in which matrix product states (MPS) are augmented with the combination of Matchgates and Clifford circuits (dubbed MCA-MPS) to take advantage of the representing power of all of them. Moreover, the optimization of MCA-MPS can be efficiently implemented within the density matrix renormalization group method. Our benchmark results on one-dimensional hydrogen chain show that MCA-MPS can improve the accuracy of the ground-state calculation by several orders of magnitude over MPS with the same bond dimension. This new method provides us a useful approach to study quantum many-body systems. The MCA-MPS ansatz also expands our understanding of classically simulatable quantum many-body states.
The recently proposed Clifford augmented density matrix renormalization group (CA-DMRG) method seamlessly integrates Clifford circuits with matrix product states and takes advantage of the expression power from both. CA-DMRG has been shown to be able to achieve higher accuracy than standard DMRG on commonly used lattice models, with only moderate computational overhead compared to the latter. In this work, we propose an efficient scheme in CA-DMRG to deal with ab initio quantum chemistry Hamiltonians and apply it to study several molecular systems. Our numerical results show that CA-DMRG can reach higher accuracy than DMRG using the same bond dimension, pointing out a promising route to push the boundary of solving ab initio quantum chemistry with strong static correlations.
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The recently proposed Clifford augmented density matrix renormalization group (CA-DMRG) method seamlessly integrates Clifford circuits with matrix product states, and takes advantage of the expression power from both. CA-DMRG has been shown to be able to achieve higher accuracy than standard DMRG on commonly used lattice models, with only moderate computational overhead compared to the latter. In this work, we propose an efficient scheme in CA-DMRG to deal with \textit{ab initio} quantum chemistry Hamiltonians, and apply it to study several molecular systems. Our numerical results show that CA-DMRG can reach higher accuracy than DMRG using the same bond dimension, pointing out a promising route to push the boundary of solving \textit{ab initio} quantum chemistry with strong static correlations.
Clifford circuits augmented matrix product states (CAMPS) was recently proposed to leverage the advantages of both Clifford circuits and matrix product states (MPS). Clifford circuits can support large entanglement and can be efficiently simulated classically according to the Gottesman-Knill theorem. So in CAMPS, MPS needs only to handle the so-called nonstabilizerness entanglement entropy which significantly improves the simulation accuracy for a given bond dimension. In this work, we generalize CAMPS to study the fermion system by taking advantage of the Jordan-Wigner transformation which can map the studied fermion system to a spin system. We benchmark the method on both the spinless $t\text{\ensuremath{-}}V$ model and the spinful Hubbard model. Our test results show significant improvement of the accuracy of CAMPS over MPS, especially when the interactions are strong. Fermionic CAMPS provides a useful tool for the accurate study of many-body fermion systems in the future and has the potential to help resolve long-standing issues.