The magnetic exchange parameters and anisotropy of the quasi-two dimensional antiferromagnet NiPS3_3

Neutron inelastic scattering has been used to measure the magnetic excitations in powdered NiPS$_3$, a quasi-two dimensional antiferromagnet with spin $S = 1$ on a honeycomb lattice. The spectra show clear, dispersive magnons with a $\sim 7$ meV gap at the Brillouin zone center. The data were fitted using a Heisenberg Hamiltonian with a single-ion anisotropy assuming no magnetic exchange between the honeycomb planes. Magnetic exchange interactions up to the third intraplanar nearest-neighbour were required. The fits show robustly that NiPS$_3$ has an easy axis anisotropy with $\Delta = 0.3$ meV and that the third nearest-neighbour has a strong antiferromagnetic exchange of $J_3 = -6.90$ meV. The data can be fitted reasonably well with either $J_1 < 0$ or $J_1 > 0$, however the best quantitative agreement with high-resolution data indicate that the nearest-neighbour interaction is ferromagnetic with $J_1 = 1.9$ meV and that the second nearest-neighbour exchange is small and antiferromagnetic with $J_2 = -0.1$ meV. The dispersion has a minimum in the Brillouin zone corner that is slightly larger than that at the Brillouin zone center, indicating that the magnetic structure of NiPS$_3$ is close to being unstable.Comment: 21 pages, 7 figures, 33 reference

Evidence for biquadratic exchange in the quasi-two-dimensional antiferromagnet FePS3_3

FePS$_3$ is a van der Waals compound with a honeycomb lattice that is a good example of a two-dimensional antiferromagnet with Ising-like anisotropy. Neutron spectroscopy data from FePS3 were previously analysed using a straight-forward Heisenberg Hamiltonian with a single-ion anisotropy. The analysis captured most of the elements of the data, however some significant discrepancies remained. The discrepancies were most obvious at the Brillouin zone boundaries. The data are subsequently reanalysed allowing for unequal exchange between nominally equivalent nearest-neighbours, which resolves the discrepancies. The source of the unequal exchange is attributed to a biquadratic exchange term in the Hamiltonian which most probably arises from a strong magnetolattice coupling. The new parameters show that there are features consistent with Dirac magnon nodal lines along certain Brillouin zone boundaries.Comment: 8 pages, 4 figures. The following article has been accepted by the Journal of Applied Physics. After it is published, it will be found at (https://publishing.aip.org/resources/librarians/products/journals/). The article was submitted as part of a special topic edition (https://publishing.aip.org/publications/journals/special-topics/jap/2d-quantum-materials-magnetism-and-superconductivity/

Epitaxial Growth of Thin Films -- a Statistical Mechanical Model

A theoretical framework is developed to describe experiments on the structure of epitaxial thin films, particularly niobium on sapphire. We extend the hypothesis of dynamical scaling to apply to the structure of thin films from its conventional application to simple surfaces. We then present a phenomenological continuum theory that provides a good description of the observed scattering and the measured exponents. Finally the results of experiment and theory are compared.Comment: 10 pages, 3 figures, minor revisions. accepted for publication in J Phys Condense Matte

Effects of Pleistocene climatic fluctuations on the phylogeographic and demographic histories of Pacific herring (Clupea pallasii).

We gathered mitochondrial DNA sequences (557 bp from the control region in 935 specimens and 668 bp of the cytochrome b gene in 139 specimens) of Pacific herring collected from 20 nearshore localities spanning the species' extensive range along the North Pacific coastlines of Asia and North America. Haplotype diversity and nucleotide diversity were high, and three major phylogeographic lineages (sequence divergences ca. 1.5%) were detected. Using a variety of phylogenetic methods, coalescent reasoning, and molecular dating interpreted in conjunction with paleoclimatic and physiographic evidence, we infer that the genetic make-up of extant populations of C. pallasii was shaped by Pleistocene environmental impacts on the historical demography of this species. A deep genealogical split that cleanly distinguishes populations in the western vs. eastern North Pacific probably originated as a vicariant separation associated with a glacial cycle that drove the species southward and isolated two ancestral populations in Asia and North America. Another deep genealogical split may have involved either a vicariant isolation of a third herring lineage (perhaps originally in the Gulf of California) or it may have resulted simply from the long coalescent times that are possible in large populations. Coalescent analyses showed that all the three evolutionary lineages of C. pallasii experienced major expansions in their most recent histories after having remained more stable in the preceding periods. Independent of the molecular calibration chosen, populations of C. pallasii appear to have remained stable or grown throughout the periods that covered at least two major glaciations, and probably more

Bubbles, clusters and denaturation in genomic DNA: modeling, parametrization, efficient computation

The paper uses mesoscopic, non-linear lattice dynamics based (Peyrard-Bishop-Dauxois, PBD) modeling to describe thermal properties of DNA below and near the denaturation temperature. Computationally efficient notation is introduced for the relevant statistical mechanics. Computed melting profiles of long and short heterogeneous sequences are presented, using a recently introduced reparametrization of the PBD model, and critically discussed. The statistics of extended open bubbles and bound clusters is formulated and results are presented for selected examples.Comment: to appear in a special issue of the Journal of Nonlinear Mathematical Physics (ed. G. Gaeta

Experimental and theoretical studies of sequence effects on the fluctuation and melting of short DNA molecules

Understanding the melting of short DNA sequences probes DNA at the scale of the genetic code and raises questions which are very different from those posed by very long sequences, which have been extensively studied. We investigate this problem by combining experiments and theory. A new experimental method allows us to make a mapping of the opening of the guanines along the sequence as a function of temperature. The results indicate that non-local effects may be important in DNA because an AT-rich region is able to influence the opening of a base pair which is about 10 base pairs away. An earlier mesoscopic model of DNA is modified to correctly describe the time scales associated to the opening of individual base pairs well below melting, and to properly take into account the sequence. Using this model to analyze some characteristic sequences for which detailed experimental data on the melting is available [Montrichok et al. 2003 Europhys. Lett. {\bf 62} 452], we show that we have to introduce non-local effects of AT-rich regions to get acceptable results. This brings a second indication that the influence of these highly fluctuating regions of DNA on their neighborhood can extend to some distance.Comment: To be published in J. Phys. Condensed Matte