Scaling Regimes, Crossovers, and Lattice Corrections in 2D Heisenberg Antiferromagnets

We study scaling behavior in 2D, S=1/2 and S=1 Heisenberg antiferromagnets using the data on full q-dependences of the equal time structure factor and the static susceptibility, calculated through high temperature expansions. We also carry out comparisons with a model of two coupled S=1/2 planes with the interlayer coupling tuned to the T=0 critical point. We separately determine the spin-wave velocity c and mass $m=c/\xi$, in addition to the correlation length, $\xi$, and find that c is temperature dependent; only for T\alt JS, it approaches its known T=0 value $c_0$. Despite this temperature dependent spin-wave velocity, full q- and $\omega$-dependences of the dynamical susceptibility $\chi(\bf q,\omega)$ agree with the universal scaling functions computable for the $\sigma$-model, for temperatures upto $T_0 \sim 0.6c_0/a$. Detailed comparisons show that below $T_0$ the S=1 model is in the renormalized classical (RC) regime, the two plane model is in the quantum critical (QC) regime, and the S=1/2 model exhibits a RC-QC crossover, centered at T=0.55J. In particular, for the S=1/2 model above this crossover and for the two-plane model at all T, the spin-wave mass is in excellent agreement with the universal QC prediction, $m\simeq 1.04\,T$. In contrast, for the S=1/2 model below the RC-QC crossover, and for the S=1 model at all T, the behavior agrees with the known RC expression. For all models nonuniversal behavior occurs above $T\sim 0.6c_0/a$. Our results strongly support the conjecture of Chubukov and Sachdev that the S=1/2 model is close to the T=0 critical point to exhibit QC behavior.Comment: 13 pages, REVTeX with attached PostScript (see file for addl info

NMR relaxation in half-integer antiferromagnetic spin chains

Nuclear relaxation in half-integer spin chains at low temperatures (T << J, the antiferromagnetic exchange constant) is dominated by dissipation from a gas of thermally-excited, overdamped, spinons. The universal low temperature dependence of the relaxation rates $1/T_1$ and $1/T_{2G}$ is computed.Comment: 7 pages, 1 uuencoded postscript figure appende

Stability of the doped antiferromagnetic state of the t-t'-Hubbard model

The next-nearest-neighbour hopping term t' is shown to stabilize the AF state of the doped Hubbard model with respect to transverse perturbations in the order- parameter by strongly suppressing the intraband particle-hole processes. For a fixed sign of t', this stabilization is found to be significantly different for electron and hole doping, which qualitatively explains the observed difference in the degree of robustness of the AF state in the electron-doped (Nd_{2-x}Ce_{x}CuO_{4}) and hole-doped (La_{2-x}Sr_{x}CuO_{4}) cuprates. The t'-U phase diagram is obtained for both signs of the t' term, showing the different regions of stability and instability of the doped antiferromagnet. Doping is shown to suppress the t'-induced frustration due to the competing interaction J'. A study of transverse spin fluctuations in the metallic AF state reveals that the decay of magnons into particle-hole excitations yields an interesting low-energy result \Gamma \sim \omega for magnon damping.Comment: 10 pages, 8 figure

Electric field gradients in MgB2_2 synthesized at high pressure: 111^111Cd TDPAC study and ab initio calculation

We report the high-pressure synthesis of novel superconductor MgB$_2$ and some related compounds. The superconducting transition temperature of our samples of MgB$_2$ is equal to 36.6 K. The MgB$_2$ lattice parameters determined via X-ray diffraction are in excellent agreement with results of our ab initio calculations. The time-differential perturbed angular correlation (TDPAC) experiments demonstrate a small increase in quadrupole frequency of $^111$Cd probe with decreasing temperature from 293 to 4.2 K. The electric field gradient (EFG) at the B site calculated from first principles is in fair agreement with EFG obtained from $^11$B NMR spectra of MgB$_2$ reported in the literature. It is also very close to EFG found in our $^111$Cd TDPAC measurements, which suggests that the $^111$Cd probe substitutes for boron in the MgB$_2$ lattice.Comment: 10 pages, 3 figure

Phase diagram for a class of spin-half Heisenberg models interpolating between the square-lattice, the triangular-lattice and the linear chain limits

We study the spin-half Heisenberg models on an anisotropic two-dimensional lattice which interpolates between the square-lattice at one end, a set of decoupled spin-chains on the other end, and the triangular-lattice Heisenberg model in between. By series expansions around two different dimer ground states and around various commensurate and incommensurate magnetically ordered states, we establish the phase diagram for this model of a frustrated antiferromagnet. We find a particularly rich phase diagram due to the interplay of magnetic frustration, quantum fluctuations and varying dimensionality. There is a large region of the usual 2-sublattice Ne\'el phase, a 3-sublattice phase for the triangular-lattice model, a region of incommensurate magnetic order around the triangular-lattice model, and regions in parameter space where there is no magnetic order. We find that the incommensurate ordering wavevector is in general altered from its classical value by quantum fluctuations. The regime of weakly coupled chains is particularly interesting and appears to be nearly critical.Comment: RevTeX, 15 figure

Confining string and P-vortices in the indirect Z(2) projection of SU(2) lattice gauge theory

We study the distribution of P-vortices near the confining string in the indirect Z(2) projection of SU(2) lattice gauge theory. It occurs that the density of vortices is constant at large distances and strongly suppressed near the line connecting the test quark-antiquark pair. This means that the condensate of P-vortices is broken inside the confining string. We also find that the width of the P-vortex density distribution is proportional to the logarithm of the distance between the quark and antiquark.Comment: 3 pages, 4 figures, Lattice2002(topology), 2 references added, minor change

Systematic 1/S study of the 2D Hubbard model at half-filling

The 2D Hubbard model is extended by placing 2S orbitals at each lattice site and studied in a systematic 1/S expansion. The 1/S results for the magnetic susceptibility and the spectra of spin-wave excitations at half-filling are consistent with the large S calculations for the Heisenberg antiferromagnet. The 1/S corrections to the fermionic spectrum lift the degeneracy along the edge of the magnetic Brillouin zone yielding minima at (+- pi/2, +- pi/2). Relation to previous papers on the subject is discussed.Comment: 18 pages, emTex version 3.

Electronic Structure and Heavy Fermion Behavior in LiV_2O_4

First principles density functional calculations of the electronic and magnetic properties of spinel-structure LiV$_{2}$O$_{4}$ have been performed using the full potential linearized augmented planewave method. The calculations show that the electronic structure near the Fermi energy consists of a manifold of 12 bands derived from V $t_{2g}$ states, weakly hybridized with O p states. While the total width of this active manifold is approximately 2 eV, it may be roughly decomposed into two groups: high velocity bands and flatter bands, although these mix in density functional calculations. The flat bands, which are the more atomic-like lead to a high density of states and magnetic instability of local moment character. The value of the on-site exchange energy is sensitive to the exact exchange correlation parameterization used in the calculations, but is much larger than the interaction between neighboring spins, reflecting the weak coupling of the magnetic system with the high velocity bands. A scenario for the observed heavy fermion behavior is discussed in which conduction electrons in the dispersive bands are weakly scattered by local moments associated with strongly correlated electrons in the heavy bands.This is analogous to that in conventional Kondo type heavy fermions, but is unusual in that both the local moments and conduction electrons come from the same d-manifold.Comment: 6 Revtex pages, Postscript figs embedded. Revision: figure 4 replaced with a better version, showing the band character explicitel