Antiferromagnetic order in systems with doublet $S_{\rm tot}=1/2$ ground states

Abstract

We use projector Quantum Monte-Carlo methods to study the $S_{\rm tot}=1/2$ doublet ground states of two dimensional $S=1/2$ antiferromagnets on a $L \times L$ square lattice with an odd number of sites $N_{\rm tot}=L^2$. We compute the ground state spin texture $\Phi^z(\vec{r}) = <S^z(\vec{r})>_{\uparrow}$ in $|G>_{\uparrow}$, the $S^z_{\rm tot}=1/2$ component of this doublet, and investigate the relationship between $n^z$, the thermodynamic limit of the staggered component of this ground state spin texture, and $m$, the thermodynamic limit of the magnitude of the staggered magnetization vector of the same system in the singlet ground state that obtains for even $N_{\rm tot}$. We find a univeral relationship between the two, that is independent of the microscopic details of the lattice level Hamiltonian and can be well approximated by a polynomial interpolation formula: $n^z \approx (1/3 - \frac{a}{2} -\frac{b}{4}) m + am^2+bm^3$, with $a \approx 0.288$ and $b\approx -0.306$. We also find that the full spin texture $\Phi^z(\vec{r})$ is itself dominated by Fourier modes near the antiferromagnetic wavevector in a universal way. On the analytical side, we explore this question using spin-wave theory, a simple mean field model written in terms of the total spin of each sublattice, and a rotor model for the dynamics of $\vec{n}$. We find that spin-wave theory reproduces this universality of $\Phi^z(\vec{r})$ and gives $n^z = (1-\alpha -\beta/S)m + (\alpha/S)m^2 +{\mathcal O}(S^{-2})$ with $\alpha \approx 0.013$ and $\beta \approx 1.003$ for spin-$S$ antiferromagnets, while the sublattice-spin mean field theory and the rotor model both give $n^z = 1/3 m$ for $S=1/2$ antiferromagnets. We argue that this latter relationship becomes asymptotically exact in the limit of infinitely long-range {\em unfrustrated} exchange interactions.