HubbardNet: Efficient predictions of the Bose-Hubbard model spectrum with deep neural networks

We present a deep neural network (DNN) -based model (HubbardNet) to variationally find the ground-state and excited-state wave functions of the one-dimensional and two-dimensional Bose-Hubbard model. Using this model for a square lattice with M sites, we obtain the energy spectrum as an analytical f...

Full description

Bibliographic Details
Main Authors: Ziyan Zhu, Marios Mattheakis, Weiwei Pan, Efthimios Kaxiras
Format: Article
Language:English
Published: American Physical Society 2023-10-01
Series:Physical Review Research
Online Access:http://doi.org/10.1103/PhysRevResearch.5.043084
_version_ 1797210386331598848
author Ziyan Zhu
Marios Mattheakis
Weiwei Pan
Efthimios Kaxiras
author_facet Ziyan Zhu
Marios Mattheakis
Weiwei Pan
Efthimios Kaxiras
author_sort Ziyan Zhu
collection DOAJ
description We present a deep neural network (DNN) -based model (HubbardNet) to variationally find the ground-state and excited-state wave functions of the one-dimensional and two-dimensional Bose-Hubbard model. Using this model for a square lattice with M sites, we obtain the energy spectrum as an analytical function of the on-site Coulomb repulsion, U, and the total number of particles, N, from a single training. This approach bypasses the need to solve a new Hamiltonian for each different set of values (U,N) and generalizes well even for out-of-distribution (U,N). Using HubbardNet, we identify the two ground-state phases of the Bose-Hubbard model (Mott insulator and superfluid). We show that the DNN-parametrized solutions are in excellent agreement with results from the exact diagonalization of the Hamiltonian, and it outperforms exact diagonalization in terms of computational scaling. These advantages suggest that our model is promising for efficient and accurate computation of exact phase diagrams of many-body lattice Hamiltonians.
first_indexed 2024-04-24T10:09:46Z
format Article
id doaj.art-924eeb5d2e9b4f99875357e0da1be607
institution Directory Open Access Journal
issn 2643-1564
language English
last_indexed 2024-04-24T10:09:46Z
publishDate 2023-10-01
publisher American Physical Society
record_format Article
series Physical Review Research
spelling doaj.art-924eeb5d2e9b4f99875357e0da1be6072024-04-12T17:35:28ZengAmerican Physical SocietyPhysical Review Research2643-15642023-10-015404308410.1103/PhysRevResearch.5.043084HubbardNet: Efficient predictions of the Bose-Hubbard model spectrum with deep neural networksZiyan ZhuMarios MattheakisWeiwei PanEfthimios KaxirasWe present a deep neural network (DNN) -based model (HubbardNet) to variationally find the ground-state and excited-state wave functions of the one-dimensional and two-dimensional Bose-Hubbard model. Using this model for a square lattice with M sites, we obtain the energy spectrum as an analytical function of the on-site Coulomb repulsion, U, and the total number of particles, N, from a single training. This approach bypasses the need to solve a new Hamiltonian for each different set of values (U,N) and generalizes well even for out-of-distribution (U,N). Using HubbardNet, we identify the two ground-state phases of the Bose-Hubbard model (Mott insulator and superfluid). We show that the DNN-parametrized solutions are in excellent agreement with results from the exact diagonalization of the Hamiltonian, and it outperforms exact diagonalization in terms of computational scaling. These advantages suggest that our model is promising for efficient and accurate computation of exact phase diagrams of many-body lattice Hamiltonians.http://doi.org/10.1103/PhysRevResearch.5.043084
spellingShingle Ziyan Zhu
Marios Mattheakis
Weiwei Pan
Efthimios Kaxiras
HubbardNet: Efficient predictions of the Bose-Hubbard model spectrum with deep neural networks
Physical Review Research
title HubbardNet: Efficient predictions of the Bose-Hubbard model spectrum with deep neural networks
title_full HubbardNet: Efficient predictions of the Bose-Hubbard model spectrum with deep neural networks
title_fullStr HubbardNet: Efficient predictions of the Bose-Hubbard model spectrum with deep neural networks
title_full_unstemmed HubbardNet: Efficient predictions of the Bose-Hubbard model spectrum with deep neural networks
title_short HubbardNet: Efficient predictions of the Bose-Hubbard model spectrum with deep neural networks
title_sort hubbardnet efficient predictions of the bose hubbard model spectrum with deep neural networks
url http://doi.org/10.1103/PhysRevResearch.5.043084
work_keys_str_mv AT ziyanzhu hubbardnetefficientpredictionsofthebosehubbardmodelspectrumwithdeepneuralnetworks
AT mariosmattheakis hubbardnetefficientpredictionsofthebosehubbardmodelspectrumwithdeepneuralnetworks
AT weiweipan hubbardnetefficientpredictionsofthebosehubbardmodelspectrumwithdeepneuralnetworks
AT efthimioskaxiras hubbardnetefficientpredictionsofthebosehubbardmodelspectrumwithdeepneuralnetworks