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We report a molecular dynamics study of ab initio quality of the ferroelectric phase transition in crystalline PbTiO3. We model anharmonicity accurately in terms of potential energy and polarization surfaces trained on density functional…

Materials Science · Physics 2025-04-02 Pinchen Xie , Yixiao Chen , Weinan E , Roberto Car

Quantum phase transitions play an important role in shaping the phase diagram of high-temperature cuprate superconductors. These cuprates possess intertwined orders which interact strongly with superconductivity. However, the evidence for…

Distortions of the $\sqrt3\times\sqrt3$ Sn/Ge(111) and Sn/Si(111) surfaces are shown to reflect a disproportionation of an integer pseudocharge, $Q$, related to the surface band occupancy. A novel understanding of the $(3\times3)$-1U (``1…

Materials Science · Physics 2009-11-07 G. Ballabio , G. Profeta , S. de Gironcoli , S. Scandolo , G. E. Santoro , E. Tosatti

We discuss the results of $^{75}$As Nuclear Quadrupole Resonance (NQR) and muon spin relaxation measurements in AFe$_2$As$_2$ (A= Cs, Rb) iron-based superconductors. We demonstrate that the crossover detected in the nuclear spin-lattice…

Strongly Correlated Electrons · Physics 2019-07-03 M. Moroni , G. Prando , S. Aswartham , I. Morozov , Z. Bukowski , B. Büchner , H. J. Grafe , P. Carretta

Strongly correlated electron materials are often characterized by competition and interplay of multiple quantum states. For example, in high-temperature cuprate superconductors unconventional superconductivity, spin- and charge-density wave…

Recent experiments on the antiferromagnetic intercalated transition metal dichalcogenide $\mathrm{Fe_{1/3}NbS_2}$ have demonstrated reversible resistivity switching by application of orthogonal current pulses below its magnetic ordering…

Materials Science · Physics 2021-07-07 Sophie F. Weber , Jeffrey B. Neaton

The interplay of Coulomb and electron-phonon interactions with thermal and quantum fluctuations facilitates rich phase diagrams in two-dimensional electron systems. Layered transition metal dichalcogenides hosting charge, excitonic, spin…

Strongly Correlated Electrons · Physics 2018-07-03 E. G. C. P. van Loon , M. Rösner , G. Schönhoff , M. I. Katsnelson , T. O. Wehling

The temperature evolution of structural effects associated with charge (CO) and spin order (SO) in La$_{1.67}$Sr$_{0.33}$NiO$_{4}$ has been investigated using neutron powder diffraction. We report an anomalous shrinking of the $c/a$ lattice…

Strongly Correlated Electrons · Physics 2015-03-17 A. M. Milinda Abeykoon , Emil S. Božin , Wei-Guo Yin , Genda Gu , John P. Hill , John M. Tranquada , Simon J. L. Billinge

We explore the role of phase fluctuations in a 3-dimensional s-wave superconductor, NbN, as we approach the critical disorder for the destruction of the superconducting state. Scanning tunneling spectroscopy measurements reveal that in the…

The classification of structural phase transitions as displacive or order-disorder in character is usually based on spectroscopic data above the transition. We use single crystal x-ray diffraction to investigate structural correlations in…

As the dimensionality is reduced, the world becomes more and more interesting; novel and fascinating phenomena show up which call for understanding. Physics in one dimension is a fascinating topic for theory and experiment: for the former…

Strongly Correlated Electrons · Physics 2007-05-23 Martin Dressel

Layered transition metal dichalcogenides (TMDs) are ideal systems for exploring the effects of dimensionality on correlated electronic phases such as charge density wave (CDW) order and superconductivity. In bulk NbSe2 a CDW sets in at TCDW…

We are examining the possibility of the formation of charge order in the high-temperature superconductor $\mathrm{YBa_2Cu_3O_{7-\delta}}$ (YBCO) due to interaction between the charged oxygen vacancies or di-vacancies. The molecular dynamics…

Superconductivity · Physics 2009-06-30 Vladimir S. Boyko , Roman Ya. Kezerashvili

In this work, we present a theory to address conflicting experimental claims regarding the charge density wave (CDW) state in TiSe$_2$, including whether there is a single or multiple CDW transitions and whether threefold rotation symmetry…

Strongly Correlated Electrons · Physics 2025-10-27 Daniel Muñoz-Segovia , Jörn W. F. Venderbos , Adolfo G. Grushin , Fernando de Juan

The Niobium surface is almost always covered by a native oxide layer which greatly influences the performance of superconducting devices. Here we investigate the highly stable Niobium oxide overlayer of Nb(110), which is characterised by…

We study a $U(N)\times U(N)$ symmetric scalar field model in four and three dimensions. First, using our data in four dimensions in the weak coupling region, we demonstrate explicitly that the observed first order phase transition is…

High Energy Physics - Lattice · Physics 2009-10-22 Yue Shen

Neutron diffraction measurements on multiferroic LuFe2O4 show changes in the antiferromagnetic (AFM) structure characterized by wavevector q = (1/3 1/3 1/2) as a function of electric field cooling procedures. The increase of intensity from…

Strongly Correlated Electrons · Physics 2011-11-09 A. M. Mulders , M. Bartkowiak , J. R. Hester , E. Pomjakushina , K. Conder

First order quantum phase transitions (1QPTs) are signaled, in the thermodynamic limit, by discontinuous changes in the ground state properties. These discontinuities affect expectation values of observables, including spatial correlations.…

Quantum Physics · Physics 2018-07-12 A. Yuste , C. Cartwright , G. De Chiara , A. Sanpera

In the experiments on stress-induced phase transitions in SMA strips, several interesting instability phenomena have been observed, including a necking-type instability, a shear-type instability and an orientation instability. By using the…

Classical Physics · Physics 2009-10-15 Hui-Hui Dai , Zongxi Cai

We report the observation of a pronounced third-order nonlinear Hall effect (NLHE) in 1$T$-phase VSe$_2$ nanosheets, synthesized using chemical vapor deposition (CVD). The nanosheets exhibit a charge density wave (CDW) transition at…

Mesoscale and Nanoscale Physics · Physics 2025-01-28 Zhao-Hui Chen , Xin Liao , Jing-Wei Dong , Xing-Yu Liu , Tong-Yang Zhao , Dong Li , An-Qi Wang , Zhi-Min Liao