28 research outputs found
Magnetic Phase Diagram of the Ferromagnetically Stacked Triangular XY Antiferromagnet: A Finite-Size Scaling Study
Histogram Monte-Carlo simulation results are presented for the magnetic-field
-- temperature phase diagram of the XY model on a stacked triangular lattice
with antiferromagnetic intraplane and ferromagnetic interplane interactions.
Finite-size scaling results at the various transition boundaries are consistent
with expectations based on symmetry arguments. Although a molecular-field
treatment of the Hamiltonian fails to reproduce the correct structure for the
phase diagram, it is demonstrated that a phenomenological Landau-type
free-energy model contains all the esstential features. These results serve to
complement and extend our earlier work [Phys. Rev. B {\bf 48}, 3840 (1993)].Comment: 5 pages (RevTex 3.0), 6 figures available upon request, CRPS 93-
Magnetic-Field Induced First-Order Transition in the Frustrated XY Model on a Stacked Triangular Lattice
The results of extensive Monte Carlo simulations of magnetic-field induced
transitions in the xy model on a stacked triangular lattice with
antiferromagnetic intraplane and ferromagnetic interplane interactions are
discussed. A low-field transition from the paramagnetic to a 3-state (Potts)
phase is found to be very weakly first order with behavior suggesting
tricriticality at zero field. In addition to clarifying some long-standing
ambiguity concerning the nature of this Potts-like transition, the present work
also serves to further our understanding of the critical behavior at ,
about which there has been much controversy.Comment: 10 pages (RevTex 3.0), 4 figures available upon request, CRPS-93-0
Magnetic Phase Diagram of the Ferromagnetically Stacked Triangular Ising Antiferromagnet
Histogram Monte-Carlo simulation results are presented for the magnetic-field
-- temperature phase diagram of the Ising model on a stacked triangular lattice
with antiferromagnetic intraplane and ferromagnetic interplane interactions.
Finite-size scaling results for this frustrated system at three points along
the paramagnetic transition boundary are presented which strongly suggest a
line of triciritcal points at low field and a first-order transition line at
higher fields. These results are compared with the corresponding phase diagrams
from conventional mean-field theory as well as from the Monte Carlo mean-field
calculations of Netz and Berker [Phys. Rev. Lett. {\bf 66}, 377 (1991)].Comment: 6 pages (RevTex 3.0), 8 figures available upon reques
Interplay of quantum and thermal fluctuations in a frustrated magnet
We demonstrate the presence of an extended critical phase in the transverse
field Ising magnet on the triangular lattice, in a regime where both thermal
and quantum fluctuations are important. We map out a complete phase diagram by
means of quantum Monte Carlo simulations, and find that the critical phase is
the result of thermal fluctuations destabilising an order established by the
quantum fluctuations. It is separated by two Kosterlitz-Thouless transitions
from the paramagnet on one hand and the quantum-fluctuation driven
three-sublattice ordered phase on the other. Our work provides further evidence
that the zero temperature quantum phase transition is in the 3d XY universality
class.Comment: 9 pages, revtex
Raman and infrared spectra of dimethyl ether 13C-isotopologue (CH3O13CH3) from a CCSD(T) potential energy surface
So far, no experimental data of the infrared and Raman spectra of 13C isotopologue of dimethyl ether are available. With the aim of providing some clues of its low-lying vibrational bands and with the hope of contributing in a next spectral analysis, a number of vibrational transition frequencies below 300 cmâ1 of the infrared spectrum and around 400 cmâ1 of the Raman spectrum have been predicted and their assignments were proposed. Calculations were carried out through an ab initio three dimensional potential energy surface based on a previously reported one for the most abundant dimethyl ether isotopologue (M. Villa et al., J. Phys. Chem. A 115 (2011) 13573). The potential function was vibrationally corrected and computed with a highly correlated CCSD(T) method involving the COC bending angle and the two large amplitude CH3 internal rotation degrees of freedom. Also, the Hamiltonian parameters could represent a support for the spectral characterization of this species. Although the computed vibrational term values are expected to be very accurate, an empirical adjustment of the Hamiltonian has been performed with the purpose of anticipating some workable corrections to any possible divergence of the vibrational frequencies. Also, the symmetry breaking derived from the isotopic substitution of 13C in the dimethyl ether was taken into account when the symmetrization procedure was applied
TRY plant trait database â enhanced coverage and open access
Plant traitsâthe morphological, anatomical, physiological, biochemical and phenological characteristics of plantsâdetermine how plants respond to environmental factors, affect other trophic levels, and influence ecosystem properties and their benefits and detriments to people. Plant trait data thus represent the basis for a vast area of research spanning from evolutionary biology, community and functional ecology, to biodiversity conservation, ecosystem and landscape management, restoration, biogeography and earth system modelling. Since its foundation in 2007, the TRY database of plant traits has grown continuously. It now provides unprecedented data coverage under an open access data policy and is the main plant trait database used by the research community worldwide. Increasingly, the TRY database also supports new frontiers of traitâbased plant research, including the identification of data gaps and the subsequent mobilization or measurement of new data. To support this development, in this article we evaluate the extent of the trait data compiled in TRY and analyse emerging patterns of data coverage and representativeness. Best species coverage is achieved for categorical traitsâalmost complete coverage for âplant growth formâ. However, most traits relevant for ecology and vegetation modelling are characterized by continuous intraspecific variation and traitâenvironmental relationships. These traits have to be measured on individual plants in their respective environment. Despite unprecedented data coverage, we observe a humbling lack of completeness and representativeness of these continuous traits in many aspects. We, therefore, conclude that reducing data gaps and biases in the TRY database remains a key challenge and requires a coordinated approach to data mobilization and trait measurements. This can only be achieved in collaboration with other initiatives