Locally accurate matrix product approximation to thermal states

Giacomo Giudice, Aslı Çakan, J. I. Cirac +1 more

We propose the construction of thermodynamic ensembles that minimize the R\'enyi free energy, as an alternative to Gibbs states. For large systems, the local properties of these R\'enyi ensembles coincide with those of thermal equilibrium and they can be used as approximations to thermal states. We provide algorithms to find tensor network approximations to the 2-R\'enyi ensemble. In particular, a matrix-product-state representation can be found by using gradient-based optimization on Riemannian manifolds or via a nonlinear evolution which yields the desired state as a fixed point. We analyze the performance of the algorithms and the properties of the ensembles on one-dimensional spin chains.

Jutho Haegeman, Laurens Vanderstraeten, Frank Verstraete

Yichen Huang

Alexander M. Dalzell, Fernando G. S. L. Brandão

Tomoya Takahashi, Wei-Lin Tu, Ji-Yao Chen +1 more

Studying finite-temperature properties with tensor networks is notoriously difficult, especially at low temperatures, due to the rapid growth of entanglement and the complexity of thermal states. Existing methods like purification and minimally entangled typical thermal states offer partial solutions but struggle with scalability and accuracy in low-temperature regime. To overcome these limitations, we propose a new approach based on generating-function matrix product states (GFMPS). By directly computing a large set of Bloch-type excited states, we construct Gibbs states that moderate the area-law constraint, enabling accurate and efficient approximation of low-temperature thermal behavior. Our benchmark results show magnificent agreement with both exact diagonalization and experimental observations, validating the accuracy of our approach. This method offers a promising new direction for overcoming the longstanding challenges of studying low-temperature properties within the tensor network framework. We also expect that our method will facilitate the numerical simulation of quantum materials in comparison with experimental observations.

Atsushi Iwaki, Shimizu Akira, Chisa Hotta