Challenges
Datasets
Workspaces
Papers
Discussions
Leaderboard
Log inSign up
Challenges
Datasets
Workspaces
Papers
Discussions
Leaderboard
Blog
Job Board
Q3AS

© 2026 Aqora Quantum S.A.S.

TermsPrivacyLegal Notice

arXiv:2110.12400 · Journal of Physics Condensed Matter

Effect of hole doping on the 120 degree order in the triangular lattice Hubbard model: a Hartree–Fock revisit

Mingpu Qin

Published Mar 16, 2022• 4 citations
arXivHTMLPDF

Abstract

We revisit the unrestricted Hartree Fock study on the evolution of the ground state of the Hubbard model on the triangular lattice with hole doping. At half-filling, it is known that the ground state of the Hubbard model on triangular lattice develops a 120 degree coplanar order at half-filling in the strong interaction limit, i.e., in the spin 1/2 anti-ferromagnetic Heisenberg model on the triangular lattice. The ground state property in the doped case is still in controversy even though extensive studies were performed in the past. Within Hartree Fock theory, we find that the 120 degree order persists from zero doping to about 0.3 hole doping. At 1/3 hole doping, a three-sublattice collinear order emerges in which the doped hole is concentrated on one of the three sublattices with antiferromagnetic Neel order on the remaining two sublattices, which forms a honeycomb lattice. Between the 120 degree order and 1/3 doping region, a phase separation occurs in which the 120 degree order coexists with the collinear anti-ferromagnetic order in different regions of the system. The collinear phase extends from 1/3 doping to about 0.41 doping, beyond which the ground state is paramagnetic with uniform electron density. The phase diagram from Hartree Fock could provide guidance for the future study of the doped Hubbard model on triangular lattice with more sophisticated many-body approaches.

DOI
10.1088/1361-648x/ac5e79

Related papers

Itinerant magnetism in the triangular-lattice Hubbard model at half doping: Application to twisted transition metal dichalcogenides

Yuchi He, Roman Rausch, Matthias Peschke +4 more

We use unrestricted Hartree-Fock, density matrix renormalization group, and variational projected entangled-pair state calculations to investigate the ground-state phase diagram of the triangular-lattice Hubbard model at “half doping” relative to single occupancy, i.e., at fillings of ( 1 ± 1 2 ) electrons per site. The electron-doped case has a nested Fermi surface in the noninteracting limit, and hence a weak-coupling instability toward density-wave orders whose wave vectors are determined by Fermi-surface nesting conditions. We find that at moderate-to-strong interaction strengths, other spatially modulated orders arise, with wave vectors distinct from the nesting vectors. In particular, we identify a series of closely competing, itinerant long-wavelength magnetically ordered states, yielding to uniform ferromagnetic order at the largest interaction strengths. For half-hole doping and a similar range of interaction strengths, our data indicate that magnetic orders are most likely absent.

arXiv:2311.10146•Physical review. B./Physical review. B•Dec 5, 2025•0 citations

Phase separation in the one-dimensional Hubbard model

John H. Samson

The Hartree-Fock ground-state phase diagram of the one-dimensional Hubbard model is calculated in the $μ-U$ plane, restricted to phases with no charge density modulation, extending the results presented in cond-mat/9511116. This allows antiferromagnetism, saturated ferromagnetism, spiral spin density waves and a collinear structure with unit cell $\uparrow \uparrow \downarrow \downarrow$. The spiral phase is unstable against phase separation near quarter-, half- and three-quarter-filling. For large $U$ this occurs at hole (or electron) doping of $(3t/π^{2}U)^{1/3}$ from half filling.

arXiv:cond-mat/9607011•Jul 2, 1996•0 citations

Anomalous paramagnetic phase of the Hubbard model

Takuya Okabe

A strong-coupling regime of the Hubbard model around half filling is investigated in the Hartree-Fock random-phase approximation. At half filling, besides a normal solution that gives rise to antiferromagnetic instability at ${T=T}_{\mathrm{N}}^{\mathrm{RPA}}\ensuremath{\sim}U,$ we find a solution representing the paramagnetic phase of the Mott insulator, for which we obtain the N\'eel temperature ${T}_{\mathrm{N}}\ensuremath{\sim}J$ in three-dimensional lattices. The solution is interpreted as the ferromagnetic band insulator depolarized by spin wave, the bound state of a particle-hole pair. Similarly, an anomalous metallic phase is derived from the Nagaoka ferromagnetic state. We evaluate ${T}_{\mathrm{N}}$ as a function of doping concentration x to find that it vanishes at $x\ensuremath{\simeq}0.05$ for $U/6t=4$ in a simple cubic lattice.

Physical review. B, Condensed matter•Jan 15, 1999•0 citations

Stripe order in the doped Hubbard model on the honeycomb lattice

Yang Xu, Hao Zheng, Mingpu Qin

We study the ground state properties of the doped Hubbard model with strong interactions on the honeycomb lattice by the density matrix renormalization group (DMRG) method. At half-filling, due to the absence of minus sign problem, it is now well established by large-scale quantum Monte Carlo calculations that a Dirac semimetal to antiferromagnetic Mott insulator transition occurs with the increase of the interaction strength $U$ for the Hubbard model on the honeycomb lattice. However, an understanding of the fate of the antiferromagnetic Mott insulator when holes are doped into the system is still lacking. In this work, by calculating the local spin and charge density for width-4 cylinders with DMRG, we discover a half-filled stripe order in the doped Hubbard model on the honeycomb lattice. We also perform complementary large-scale mean-field calculations with renormalized interaction strength. We observe half-filled stripe order and find stripe states with filling close to one half are nearly degenerate in energy.

arXiv:2104.14152•Physical review. B./Physical review. B•Apr 7, 2021•13 citations

Phase Separation in Hubbard Model

John H. Samson

Tle Hartree-Fock ground-state phase diagram of the one-dimensional Hubbard model is calculated in the μ-U plane, restricted to phases with no charge density modulation.This allows antiferromagnetism, saturated ferromagnetism, spiral spin density waves and a collinear structure with unit cell H e i s e n b e r g s .T h e s p i r a l p h a s e i s u n s t a b l e a g a i n s t p h a s e s e p a r a t i o n n e a r quarter-, half-and three-quarter-flling.For large U this occurs at hole (or electron) doping of (3t/π2U)1/3 from half-filling.

Acta Physica Polonica A•Aug 1, 1997•0 citations

Strongly correlated electrons on the honeycombb lattice: magnetism and superconductivity

F. G. Ribeiro

In view of quite recent experimental activities on magnetic and superconducting properties of honeycomb and hexagonal lattice based materials, in this thesis we have used field-theoretic and many-body methods to investigate magnetic and superconducting properties of the large-U Hubbard model on the honeycomb lattice at half-filling and in the hole-doped regime. Within the framework of a functional-integral approach, we obtain the Lagrangian density associated with the charge (Grassmann fields) and spin [SU(2) gauge fields] degrees of freedom. The Hamiltonian related to the charge degrees of freedom is exactly diagonalized. In the strong-coupling regime, we derive a perturbative low-energy theory suitable to describe the (quantum) magnetic and superconducting phases at half-filling and in the hole-doped regime. At half-filling, we deal with the underlying spin degrees of freedom of the quantum antiferromagnetic (AF) Heisenberg model by employing a second-order spin-wave analysis, in which case we have calculated the ground-state energy and the staggered magnetization; the results are in very good agreement with previous studies. Further, in the continuum, we derive a nonlinear σ-model with a topological Hopf term that describes the AF-VBS (valence bond solid) competition. In the challenging hole-doped regime, our approach allows the derivation of a t-J Hamiltonian, and the analysis of the role played by charge and spin quantum fluctuations on the ground-state energy and, particularly, on the breakdown of the AF order at a critical hole doping; the results are benchmarked against recent Grassmann tensor product state simulations. In addition, we have performed an extensive study of the electronic structure of the doped system for each competing phase: AF, ferromagnetic (FM), and (spin-singlet pairing) s-, dx₂₋ʏ₂ – and idxʏ -wave superconducting (SC) state induced by purely electronic effects. In this context, an energetic analysis of the ground state of these phases reveal that the AF order prevails for low hole doping, while a dominantly chiral dx₂₋ʏ₂ + idxʏ superconducting state was found in the vicinity of the Van Hove singularity (high hole doping). We also stress that a thermodynamic analysis of the superconducting phase shows that the critical temperature is directly related to the exchange constant J = 4t²/U, in which t denotes the hopping amplitude and U the on-site Coulomb repulsion of the Hubbard model (purely electronic origin). Remarkably, the competition between the AF and dx₂₋ʏ₂ + idxʏ SC phases takes place by the occurrence of a first-order transition accompanied by a spatial phase separation of the referred phases.

•Aug 28, 2015•0 citations
We revisit the unrestricted Hartree Fock study on the evolution of the ground state of the Hubbard model on the triangular lattice with hole doping. At half-filling, it is known that the ground state of the Hubbard model on triangular lattice develops a 120 degree coplanar order at half-filling in the strong interaction limit, i.e., in the spin 1/2 anti-ferromagnetic Heisenberg model on the triangular lattice. The ground state property in the doped case is still in controversy even though extensive studies were performed in the past. Within Hartree Fock theory, we find that the 120 degree order persists from zero doping to about 0.3 hole doping. At 1/3 hole doping, a three-sublattice collinear order emerges in which the doped hole is concentrated on one of the three sublattices with antiferromagnetic Neel order on the remaining two sublattices, which forms a honeycomb lattice. Between the 120 degree order and 1/3 doping region, a phase separation occurs in which the 120 degree order coexists with the collinear anti-ferromagnetic order in different regions of the system. The collinear phase extends from 1/3 doping to about 0.41 doping, beyond which the ground state is paramagnetic with uniform electron density. The phase diagram from Hartree Fock could provide guidance for the future study of the doped Hubbard model on triangular lattice with more sophisticated many-body approaches.
We use unrestricted Hartree-Fock, density matrix renormalization group, and variational projected entangled-pair state calculations to investigate the ground-state phase diagram of the triangular-lattice Hubbard model at “half doping” relative to single occupancy, i.e., at fillings of ( 1 ± 1 2 ) electrons per site. The electron-doped case has a nested Fermi surface in the noninteracting limit, and hence a weak-coupling instability toward density-wave orders whose wave vectors are determined by Fermi-surface nesting conditions. We find that at moderate-to-strong interaction strengths, other spatially modulated orders arise, with wave vectors distinct from the nesting vectors. In particular, we identify a series of closely competing, itinerant long-wavelength magnetically ordered states, yielding to uniform ferromagnetic order at the largest interaction strengths. For half-hole doping and a similar range of interaction strengths, our data indicate that magnetic orders are most likely absent.
The Hartree-Fock ground-state phase diagram of the one-dimensional Hubbard model is calculated in the μ−Uμ-Uμ−U plane, restricted to phases with no charge density modulation, extending the results presented in cond-mat/9511116. This allows antiferromagnetism, saturated ferromagnetism, spiral spin density waves and a collinear structure with unit cell ↑↑↓↓\uparrow \uparrow \downarrow \downarrow↑↑↓↓. The spiral phase is unstable against phase separation near quarter-, half- and three-quarter-filling. For large UUU this occurs at hole (or electron) doping of (3t/π2U)1/3(3t/π^{2}U)^{1/3}(3t/π2U)1/3 from half filling.
A strong-coupling regime of the Hubbard model around half filling is investigated in the Hartree-Fock random-phase approximation. At half filling, besides a normal solution that gives rise to antiferromagnetic instability at ${T=T}_{\mathrm{N}}^{\mathrm{RPA}}\ensuremath{\sim}U,$ we find a solution representing the paramagnetic phase of the Mott insulator, for which we obtain the N\'eel temperature ${T}_{\mathrm{N}}\ensuremath{\sim}J$ in three-dimensional lattices. The solution is interpreted as the ferromagnetic band insulator depolarized by spin wave, the bound state of a particle-hole pair. Similarly, an anomalous metallic phase is derived from the Nagaoka ferromagnetic state. We evaluate TN{T}_{\mathrm{N}}TN​ as a function of doping concentration x to find that it vanishes at $x\ensuremath{\simeq}0.05$ for U/6t=4U/6t=4U/6t=4 in a simple cubic lattice.
We study the ground state properties of the doped Hubbard model with strong interactions on the honeycomb lattice by the density matrix renormalization group (DMRG) method. At half-filling, due to the absence of minus sign problem, it is now well established by large-scale quantum Monte Carlo calculations that a Dirac semimetal to antiferromagnetic Mott insulator transition occurs with the increase of the interaction strength UUU for the Hubbard model on the honeycomb lattice. However, an understanding of the fate of the antiferromagnetic Mott insulator when holes are doped into the system is still lacking. In this work, by calculating the local spin and charge density for width-4 cylinders with DMRG, we discover a half-filled stripe order in the doped Hubbard model on the honeycomb lattice. We also perform complementary large-scale mean-field calculations with renormalized interaction strength. We observe half-filled stripe order and find stripe states with filling close to one half are nearly degenerate in energy.
Tle Hartree-Fock ground-state phase diagram of the one-dimensional Hubbard model is calculated in the μ-U plane, restricted to phases with no charge density modulation.This allows antiferromagnetism, saturated ferromagnetism, spiral spin density waves and a collinear structure with unit cell H e i s e n b e r g s .T h e s p i r a l p h a s e i s u n s t a b l e a g a i n s t p h a s e s e p a r a t i o n n e a r quarter-, half-and three-quarter-flling.For large U this occurs at hole (or electron) doping of (3t/π2U)1/3 from half-filling.
In view of quite recent experimental activities on magnetic and superconducting properties of honeycomb and hexagonal lattice based materials, in this thesis we have used field-theoretic and many-body methods to investigate magnetic and superconducting properties of the large-U Hubbard model on the honeycomb lattice at half-filling and in the hole-doped regime. Within the framework of a functional-integral approach, we obtain the Lagrangian density associated with the charge (Grassmann fields) and spin [SU(2) gauge fields] degrees of freedom. The Hamiltonian related to the charge degrees of freedom is exactly diagonalized. In the strong-coupling regime, we derive a perturbative low-energy theory suitable to describe the (quantum) magnetic and superconducting phases at half-filling and in the hole-doped regime. At half-filling, we deal with the underlying spin degrees of freedom of the quantum antiferromagnetic (AF) Heisenberg model by employing a second-order spin-wave analysis, in which case we have calculated the ground-state energy and the staggered magnetization; the results are in very good agreement with previous studies. Further, in the continuum, we derive a nonlinear σ-model with a topological Hopf term that describes the AF-VBS (valence bond solid) competition. In the challenging hole-doped regime, our approach allows the derivation of a t-J Hamiltonian, and the analysis of the role played by charge and spin quantum fluctuations on the ground-state energy and, particularly, on the breakdown of the AF order at a critical hole doping; the results are benchmarked against recent Grassmann tensor product state simulations. In addition, we have performed an extensive study of the electronic structure of the doped system for each competing phase: AF, ferromagnetic (FM), and (spin-singlet pairing) s-, dx₂₋ʏ₂ – and idxʏ -wave superconducting (SC) state induced by purely electronic effects. In this context, an energetic analysis of the ground state of these phases reveal that the AF order prevails for low hole doping, while a dominantly chiral dx₂₋ʏ₂ + idxʏ superconducting state was found in the vicinity of the Van Hove singularity (high hole doping). We also stress that a thermodynamic analysis of the superconducting phase shows that the critical temperature is directly related to the exchange constant J = 4t²/U, in which t denotes the hopping amplitude and U the on-site Coulomb repulsion of the Hubbard model (purely electronic origin). Remarkably, the competition between the AF and dx₂₋ʏ₂ + idxʏ SC phases takes place by the occurrence of a first-order transition accompanied by a spatial phase separation of the referred phases.