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Register a new userTriangular Snowflakes: Growing Structures with Three-fold Symmetry using a Hexagonal Ice Crystal Lattice
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Added by
Kenneth G. Libbrecht
Publication date
2021
fields
Physics
and research's language is
English
Authors
Kenneth G. Libbrecht
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Snow crystals growing from water vapor occasionally exhibit morphologies with three-fold (trigonal) symmetry, even though the ice crystal lattice has a molecular structure with six-fold symmetry. In extreme cases, thin platelike snow crystals can grow into faceted forms that resemble simple equilateral triangles. Although far less common than hexagonal forms, trigonal snow crystals have long been observed both in nature and in laboratory studies, and their origin has been an enduring scientific puzzle. In this paper I describe how platelike trigonal structures can be grown on the ends of slender ice needles in air with high reliability at -14 C. I further suggest a physical model that describes how such structures can self-assemble and develop, facilitated by an edge-sharpening instability that turns on at a specific combination of temperature and water-vapor supersaturation. The results generally support a comprehensive model of structure-dependent attachment kinetics in ice growth that has been found to explain many of the overarching behaviors seen in the Nakaya diagram of snow crystal morphologies.
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I examine a variety of snow crystal growth measurements taken at a temperature of -5 C, as a function of supersaturation, background gas pressure, and crystal morphology. Both plate-like and columnar prismatic forms are observed under different conditions at this temperature, along with a diverse collection of complex dendritic structures. The observations can all be reasonably understood using a single comprehensive physical model for the basal and prism attachment kinetics, together with particle diffusion of water vapor through the surrounding medium and other well-understood physical processes. A critical model feature is structure-dependent attachment kinetics (SDAK), for which the molecular attachment kinetics on a faceted surface depend strongly on the nearby mesoscopic structure of the crystal.
Hexagonal manganites REMnO3 (RE, rare earths) have attracted significant attention due to their potential applications as multiferroic materials and the intriguing physics associated with the topological defects. The two-dimensional (2D) and 3D domain and vortex structure evolution of REMnO3 is predicted using the phase-field method based on a thermodynamic potential constructed from first-principles calculations. In 3D spaces, vortex lines show three types of topological changes, i.e. shrinking, coalescence, and splitting, with the latter two caused by the interaction and exchange of vortex loops. Compared to the coarsening rate of the isotropic XY model, the six-fold degeneracy gives rise to negligible differences with the vortex-antivortex annihilation controlling the scaling dynamics, whereas the anisotropy of interfacial energy results in a deviation. The temporal evolution of domain and vortex structures serves as a platform to fully explore the mesoscale mechanisms for the 0-D and 1-D topological defects.
An unusual crystallographic orientation of hexagonal Ru with a 4-fold symmetry emerging in epitaxial MgO/Ru/Co2FeAl/MgO heterostructures is reported, in which an approximately Ru(02-23) growth attributes to the lattice matching among MgO, Ru, and Co2FeAl. Perpendicular magnetic anisotropy of the Co2FeAl/MgO interface is substantially enhanced as compared with those with a Cr(001) layer. The MTJs incorporating this structure gave rise to the largest tunnel magnetoresistance for perpendicular MTJs using low damping Heusler alloys. The 4-fold-symmetry hexagonal Ru arises from an epitaxial growth with an unprecedentedly high crystal index, opening a unique pathway for the development of perpendicular anisotropy films of cubic and tetragonal ferromagnetic alloys.
According to a recent proposal [S. Takayama et al., Appl. Phys. Lett. 87, 061107 (2005)], the triangular lattice of triangular air holes may allow to achieve a complete photonic band gap in two-dimensional photonic crystal slabs. In this work we present a systematic theoretical study of this photonic lattice in a high-index membrane, and a comparison with the conventional triangular lattice of circular holes, by means of the guided-mode expansion method whose detailed formulation is described here. Photonic mode dispersion below and above the light line, gap maps, and intrinsic diffraction losses of quasi-guided modes are calculated for the periodic lattice as well as for line- and point-defects defined therein. The main results are summarized as follows: (i) the triangular lattice of triangular holes does indeed have a complete photonic band gap for the fundamental guided mode, but the useful region is generally limited by the presence of second-order waveguide modes; (ii) the lattice may support the usual photonic band gap for even modes (quasi-TE polarization) and several band gaps for odd modes (quasi-TM polarization), which could be tuned in order to achieve doubly-resonant frequency conversion between an even mode at the fundamental frequency and an odd mode at the second-harmonic frequency; (iii) diffraction losses of quasi-guided modes in the triangular lattices with circular and triangular holes, and in line-defect waveguides or point-defect cavities based on these geometries, are comparable. The results point to the interest of the triangular lattice of triangular holes for nonlinear optics, and show the usefulness of the guided-mode expansion method for calculating photonic band dispersion and diffraction losses, especially for higher-lying photonic modes.
We show how an embedded many-body expansion (EMBE) can be used to calculate accurate emph{ab initio} energies of water clusters and ice structures using wavefunction-based methods. We use the EMBE described recently by Bygrave emph{et al.} (J. Chem. Phys. textbf{137}, 164102 (2012)), in which the terms in the expansion are obtained from calculations on monomers, dimers, etc. acted on by an approximate representation of the embedding field due to all other molecules in the system, this field being a sum of Coulomb and exchange-repulsion fields. Our strategy is to separate the total energy of the system into Hartree-Fock and correlation parts, using the EMBE only for the correlation energy, with the Hartree-Fock energy calculated using standard molecular quantum chemistry for clusters and plane-wave methods for crystals. Our tests on a range of different water clusters up to the 16-mer show that for the second-order Mo{}ller-Plesset (MP2) method the EMBE truncated at 2-body level reproduces to better than 0.1 m$E_{rm h}$/monomer the correlation energy from standard methods. The use of EMBE for computing coupled-cluster energies of clusters is also discussed. For the ice structures Ih, II and VIII, we find that MP2 energies near the complete basis-set limit reproduce very well the experimental values of the absolute and relative binding energies, but that the use of coupled-cluster methods for many-body correlation (non-additive dispersion) is essential for a full description. Possible future applications of the EMBE approach are suggested.
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