相关论文: Rigid unit modes in tetrahedral crystals
We analyze the implication of off-diagonal long-range order (ODLRO) for inhomogeneous periodic field configurations and multi-component order parameters. For single component order parameters we show that the only static, periodic field…
Motivated by the experimental synthesis of two-dimensional (2D) perovskite materials, we study the stability of 2D SrTiO$_3$ from first principles. We find that the TiO$_6$ octahedral rotations emerge in 2D SrTiO$_3$ with a rotation angle…
We present a systematic first-principles study of the structural and vibrational properties of perovskite-structure EuTiO3. Our calculated phonon spectrum of the high-symmetry cubic structural prototype shows strong M- and R-point…
The pyrochlore ruthenate In$_2$Ru$_2$O$_7$ displays a subtle competition between spin-orbital entanglement and molecular orbital formation. At room temperature, a spin-orbit-entangled singlet state was identified. With decreasing…
We investigate the mechanism of the resonant X-ray scattering on the Ti $K$ edge region of YTiO$_3$ using the band structure calculation combined with the local density approximation. A large intensity is obtained for the orbital…
We study $\epsilon$-representations of discrete groups by unitary operators on a Hilbert space. We define the notion of Ulam stability of a group which loosely means that finite-dimensional $\epsilon$-represendations are uniformly close to…
We consider the transition from a spatially uniform state to a steady, spatially-periodic pattern in a partial differential equation describing long-wavelength convection. This both extends existing work on the study of rolls, squares and…
The strongly correlated cuprate Cu$_2$OSeO$_3$ has recently been identified as the first insulating system exhibiting a skyrmion lattice phase. Using a microscopic multi-boson theory for its magnetic ground state and excitations, we…
It is shown theoretically that a one-dimensional crystal with time reversal symmetry is characterized by a Z_{2} topological invariant that predicts the existence or otherwise of edge states. This is confirmed experimentally through the…
The Hilbert manifold $\Sigma$ consisting of positive invertible (unitized) Hilbert-Schmidt operators has a rich structure and geometry. The geometry of unitary orbits $\Omega\subset \Sigma$ is studied from the topological and metric…
Let $\mathcal{D}$ be a Hom-finite, Krull-Schmidt, 2-Calabi-Yau triangulated category with a rigid object $R$. Let $\Lambda=\operatorname{End}_{\mathcal{D}}R$ be the endomorphism algebra of $R$. We introduce the notion of mutation of maximal…
The quest for new realizations of higher-order topological system has garnered much recent attention. In this work, we propose a paradigmatic brick lattice model where corner modes requires protection by nonsymmorphic symmetry in addition…
Spinel compounds AB$_{2}$X$_{4}$ consist of both tetrahedral (AX$_{4}$) and octahedral (BX$_{6}$) environments with the former forming a diamond lattice and the latter a geometrically frustrated pyrochlore lattice. Exploring the fascinating…
Rotations and distortions of oxygen octahedra in perovskites play a key role in determining their functional properties. Here we investigate how octahedral rotations can couple from one material to another in…
Symmetries are so involved in crystallographic detail that it is indispensable when crystal cell or lattice is mentioned. For nanocrystals, however, many are 'systemic symmetries', meaning that the whole structures of nanocrystal particles…
Recent state-of-the-art crystallographic investigations of transition metal spinel compounds have revealed that the d- orbital charge carriers undergo ordering transitions with the formation of local "molecular bonding" units such as dimers…
The 5d pyrochlore oxide superconductor Cd2Re2O7 (CRO) has attracted significant interest as a spin-orbit-coupled metal (SOCM) that spontaneously undergoes a phase transition to an odd-parity multipole phase by breaking the spatial inversion…
Ensembles of particles rotating in a two-dimensional fluid can exhibit chaotic dynamics yet develop signatures of hidden order. Such "rotors" are found in the natural world spanning vastly disparate length scales - from the rotor proteins…
We report crystal growth and Raman spectroscopy characterization of pure and mixed bulk topological insulators. The series comprises of both binary and ternary tetradymite topological insulators. We analyzed in detail the Raman peaks of…
The edge states of the recently proposed quantum spin Hall systems constitute a new symmetry class of one-dimensional liquids dubbed the ``helical liquid'', where the spin orientation is determined by the direction of electron motion. We…