Highly frustrated spin-lattice models of magnetism and their quantum phase transitions: A microscopic treatment via the coupled cluster method

We outline how the coupled cluster method of microscopic quantum many-body theory can be utilized in practice to give highly accurate results for the ground-state properties of a wide variety of highly frustrated and strongly correlated spin-lattice models of interest in quantum magnetism, including their quantum phase transitions. The method itself is described, and it is shown how it may be implemented in practice to high orders in a systematically improvable hierarchy of (so-called LSUB$m$) approximations, by the use of computer-algebraic techniques. The method works from the outset in the thermodynamic limit of an infinite lattice at all levels of approximation, and it is shown both how the "raw" LSUB$m$ results are themselves generally excellent in the sense that they converge rapidly, and how they may accurately be extrapolated to the exact limit, $m \rightarrow \infty$, of the truncation index $m$, which denotes the {\it only} approximation made. All of this is illustrated via a specific application to a two-dimensional, frustrated, spin-half $J^{XXZ}_{1}$--$J^{XXZ}_{2}$ model on a honeycomb lattice with nearest-neighbor and next-nearest-neighbor interactions with exchange couplings $J_{1}>0$ and $J_{2} \equiv \kappa J_{1} > 0$, respectively, where both interactions are of the same anisotropic $XXZ$ type. We show how the method can be used to determine the entire zero-temperature ground-state phase diagram of the model in the range $0 \leq \kappa \leq 1$ of the frustration parameter and $0 \leq \Delta \leq 1$ of the spin-space anisotropy parameter. In particular, we identify a candidate quantum spin-liquid region in the phase space

Spin-1/2 J1J_{1}-J2J_{2} Heisenberg model on a cross-striped square lattice

Using the coupled cluster method (CCM) we study the full (zero-temperature) ground-state (GS) phase diagram of a spin-half ($s=1/2$) $J_{1}$-$J_{2}$ Heisenberg model on a cross-striped square lattice. Each site of the square lattice has 4 nearest-neighbour exchange bonds of strength $J_{1}$ and 2 next-nearest-neighbour (diagonal) bonds of strength $J_{2}$. The $J_{2}$ bonds are arranged so that the basic square plaquettes in alternating columns have either both or no $J_{2}$ bonds included. The classical ($s \rightarrow \infty$) version of the model has 4 collinear phases when $J_{1}$ and $J_{2}$ can take either sign. Three phases are antiferromagnetic (AFM), showing so-called N\'{e}el, double N\'{e}el and double columnar striped order respectively, while the fourth is ferromagnetic. For the quantum $s=1/2$ model we use the 3 classical AFM phases as CCM reference states, on top of which the multispin-flip configurations arising from quantum fluctuations are incorporated in a systematic truncation hierarchy. Calculations of the corresponding GS energy, magnetic order parameter and the susceptibilities of the states to various forms of valence-bond crystalline (VBC) order are thus carried out numerically to high orders of approximation and then extrapolated to the (exact) physical limit. We find that the $s=1/2$ model has 5 phases, which correspond to the four classical phases plus a new quantum phase with plaquette VBC order. The positions of the 5 quantum critical points are determined with high accuracy. While all 4 phase transitions in the classical model are first order, we find strong evidence that 3 of the 5 quantum phase transitions in the $s=1/2$ model are of continuous deconfined type

A frustrated spin-1/2 Heisenberg antiferromagnet on a chevron-square lattice

The coupled cluster method (CCM) is used to study the zero-temperature properties of a frustrated spin-half ($s={1}{2}$) $J_{1}$--$J_{2}$ Heisenberg antiferromagnet (HAF) on a 2D chevron-square lattice. Each site on an underlying square lattice has 4 nearest-neighbor exchange bonds of strength $J_{1}>0$ and 2 next-nearest-neighbor (diagonal) bonds of strength $J_{2} \equiv x J_{1}>0$, with each square plaquette having only one diagonal bond. The diagonal bonds form a chevron pattern, and the model thus interpolates smoothly between 2D HAFs on the square ($x=0$) and triangular ($x=1$) lattices, and also extrapolates to disconnected 1D HAF chains ($x \to \infty$). The classical ($s \to \infty$) version of the model has N\'{e}el order for $0 < x < x_{{\rm cl}}$ and a form of spiral order for $x_{{\rm cl}} < x < \infty$, where $x_{{\rm cl}} = {1}{2}$. For the $s={1}{2}$ model we use both these classical states, as well as other collinear states not realized as classical ground-state (GS) phases, as CCM reference states, on top of which the multispin-flip configurations resulting from quantum fluctuations are incorporated in a systematic truncation scheme, which we carry out to high orders and extrapolate to the physical limit. We calculate the GS energy, GS magnetic order parameter, and the susceptibilities of the states to various forms of valence-bond crystalline (VBC) order, including plaquette and two different dimer forms. We find that the $s={1}{2}$ model has two quantum critical points, at $x_{c_{1}} \approx 0.72(1)$ and $x_{c_{2}} \approx 1.5(1)$, with N\'{e}el order for $0 < x < x_{c_{1}}$, a form of spiral order for $x_{c_{1}} < x < x_{c_{2}}$ that includes the correct three-sublattice $120^{\circ}$ spin ordering for the triangular-lattice HAF at $x=1$, and parallel-dimer VBC order for $x_{c_{2}} < x < \infty$

Dynamical study on polaron formation in a metal/polymer/metal structure

By considering a metal/polymer/metal structure within a tight-binding one-dimensional model, we have investigated the polaron formation in the presence of an electric field. When a sufficient voltage bias is applied to one of the metal electrodes, an electron is injected into the polymer chain, then a self-trapped polaron is formed at a few hundreds of femtoseconds while it moves slowly under a weak electric field (not larger than $$ V/cm). At an electric field between $1.0\times 10^4$ V/cm and $$ V/cm, the polaron is still formed, since the injected electron is bounded between the interface barriers for quite a long time. It is shown that the electric field applied at the polymer chain reduces effectively the potential barrier in the metal/polymer interface

Universality and quantum effects in one-component critical fluids

Non-universal scale transformations of the physical fields are extended to pure quantum fluids and used to calculate susceptibility, specific heat and the order parameter along the critical isochore of He3 near its liquid-vapor critical point. Within the so-called preasymptotic domain, where the Wegner expansion restricted to the first term of confluent corrections to scaling is expected valid, the results show agreement with the experimental measurements and recent predictions, either based on the minimal-substraction renormalization and the massive renormalization schemes within the $\Phi\_{d=3}^{4}(n=1)$-model, or based on the crossover parametric equation of state for Ising-like systems

The frustrated Heisenberg antiferromagnet on the honeycomb lattice: J1J_{1}--J2J_{2} model

We study the ground-state (gs) phase diagram of the frustrated spin-1/2 $J_{1}$--$J_{2}$ antiferromagnet with $J_{2}=\kappa J_1>0$ ($J_{1}>0$) on the honeycomb lattice, using the coupled-cluster method. We present results for the ground-state energy, magnetic order parameter and plaquette valence-bond crystal (PVBC) susceptibility. We find a paramagnetic PVBC phase for $\kappa_{c_1}<\kappa<\kappa_{c_2}$, where $\kappa_{c_1} \approx 0.207 \pm 0.003$ and $\kappa_{c_2} \approx 0.385 \pm 0.010$. The transition at $\kappa_{c_1}$ to the N\'{e}el phase seems to be a continuous deconfined transition (although we cannot exclude a very narrow intermediate phase in the range $0.21 \lesssim \kappa \lesssim 0.24$), while that at $\kappa_{c_2}$ is of first-order type to another quasiclassical antiferromagnetic phase that occurs in the classical version of the model only at the isolated and highly degenerate critical point $\kappa = 1/2$. The spiral phases that are present classically for all values $\kappa > 1/6$ are absent for all $\kappa \lesssim 1$.Comment: 6 pages, 5 figure

Frustrated Heisenberg antiferromagnet on the honeycomb lattice: Spin gap and low-energy parameters

We use the coupled cluster method implemented to high orders of approximation to investigate the frustrated spin-$\frac{1}{2}$ $J_{1}$--$J_{2}$--$J_{3}$ antiferromagnet on the honeycomb lattice with isotropic Heisenberg interactions of strength $J_{1} > 0$ between nearest-neighbor pairs, $J_{2}>0$ between next-nearest-neighbor pairs, and $J_{3}>0$ between next-next-neareast-neighbor pairs of spins. In particular, we study both the ground-state (GS) and lowest-lying triplet excited-state properties in the case $J_{3}=J_{2} \equiv \kappa J_{1}$, in the window $0 \leq \kappa \leq 1$ of the frustration parameter, which includes the (tricritical) point of maximum classical frustration at $\kappa_{{\rm cl}} = \frac{1}{2}$. We present GS results for the spin stiffness, $\rho_{s}$, and the zero-field uniform magnetic susceptibility, $\chi$, which complement our earlier results for the GS energy per spin, $E/N$, and staggered magnetization, $M$, to yield a complete set of accurate low-energy parameters for the model. Our results all point towards a phase diagram containing two quasiclassical antiferromagnetic phases, one with N\'eel order for $\kappa < \kappa_{c_{1}}$, and the other with collinear striped order for $\kappa > \kappa_{c_{2}}$. The results for both $\chi$ and the spin gap $\Delta$ provide compelling evidence for a quantum paramagnetic phase that is gapped over a considerable portion of the intermediate region $\kappa_{c_{1}} < \kappa < \kappa_{c_{2}}$, especially close to the two quantum critical points at $\kappa_{c_{1}}$ and $\kappa_{c_{2}}$. Each of our fully independent sets of results for the low-energy parameters is consistent with the values $\kappa_{c_{1}} = 0.45 \pm 0.02$ and $\kappa_{c_{2}} = 0.60 \pm 0.02$, and with the transition at $\kappa_{c_{1}}$ being of continuous (and probably of the deconfined) type and that at $\kappa_{c_{2}}$ being of first-order type

Engineering calculations for communications satellite systems planning

An extended gradient search code for broadcasting satellite service (BSS) spectrum/orbit assignment synthesis is discussed. Progress is also reported on both single-entry and full synthesis computational aids for fixed satellite service (FSS) spectrum/orbit assignment purposes

Low temperature field-effect in crystalline organic material

Molecular organic materials offer the promise of novel electronic devices but also present challenges for understanding charge transport in narrow band systems. Low temperature studies elucidate fundamental transport processes. We report the lowest temperature field effect transport results on a crystalline oligomeric organic material, rubrene. We find field effect switching with on-off ratio up to 10^7 at temperatures down to 10 K. Gated transport shows a factor of ~10 suppression of the thermal activation energy in 10-50 K range and nearly temperature independent resistivity below 10 K.Comment: 5 pages, 4 figure