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We review our recent development of a first-principles lattice dynamics method that can treat anharmonic effects nonperturbatively. The method is based on the self-consistent phonon theory and temperature-dependent phonon frequencies can be…

Materials Science · Physics 2018-01-29 Terumasa Tadano , Shinji Tsuneyuki

We present a study of the lattice dynamical properties of superconducting SrPt$_3$P ($T_c = 8.4$ K) via high-resolution inelastic x-ray scattering (IXS) and ab initio calculations. Density functional perturbation theory including spin-orbit…

Superconductivity · Physics 2016-01-20 D. A. Zocco , S. Krannich , R. Heid , K. -P. Bohnen , T. Wolf , T. Forrest , A. Bossak , F. Weber

To be useful, steady state thermodynamics (SST) must be self-consistent and have predictive value. Although consistency of SST was recently verified for driven lattice gases under global weak exchange, I show here that it does not predict…

Statistical Mechanics · Physics 2014-07-31 Ronald Dickman

Phonon decoherence determines the characteristic timescales over which coherent lattice vibrations decay, making it a crucial process for understanding the non-equilibrium dynamics of crystal lattices after excitation by a pump pulse. Here,…

Strongly Correlated Electrons · Physics 2025-02-04 Yiming Pan , Christoph Emeis , Stephan Jauernik , Michael Bauer , Fabio Caruso

The thermodynamic stability of the hard-sphere gas has been examined, using the formalism of scaled particle theory [SPT], and by applying explicitly the conditions of stability required by both the second and third laws of thermodynamics.…

Statistical Mechanics · Physics 2007-05-23 J. F. Kenney

The low-dimensional s=1/2 compound (NO)[Cu(NO3)3] has recently been suggested to follow the Nersesyan-Tsvelik model of coupled spin chains. Such a system shows unbound spinon excitations and a resonating valence bond ground state due spin…

Strongly Correlated Electrons · Physics 2022-06-08 V. Gnezdilov , P. Lemmens , Yu. G. Pashkevich , D. Wulferding , I. V. Morozov , O. S. Volkova , A. Vasiliev

The tin sulfides represent a materials platform for earth-abundant semiconductor technologies. We present a first-principles study of the five known and proposed phases of SnS together with SnS2 and Sn2S3. Lattice-dynamics techniques are…

Materials Science · Physics 2017-03-17 Jonathan M. Skelton , Lee A. Burton , Fumiyasu Oba , Aron Walsh

The numerical solutions of nonlocal and local Boltzmann kinetic equations for the simulation of central heavy ion reactions are parameterized in terms of time dependent thermodynamical variables in the Fermi liquid sense. This allows one to…

Nuclear Theory · Physics 2009-11-06 Klaus Morawetz

The decay rate for a particle in a metastable cubic potential is investigated in the quantum regime by the Euclidean path integral method in semiclassical approximation. The imaginary time formalism allows one to monitor the system as a…

Statistical Mechanics · Physics 2008-04-22 Marco Zoli

A phenomenological model is proposed for melting of a vortex lattice, based on screening of the elastic shear modulus by mobile or partially pinned dislocations. A first-order softening line is found and ends at a critical point beyond…

Superconductivity · Physics 2007-05-23 Denis Feinberg

After a rapid increase in temperature across the deconfinement temperature $% T_{d}$, pure gauge theories exhibit unstable long wavelength fluctuations in the approach to equilibrium. This phenomenon is analogous to spinodal decomposition…

High Energy Physics - Lattice · Physics 2009-10-31 Travis R. Miller , Michael C. Ogilvie

We consider an out-of-equilibrium lattice model consisting of 2D discrete rotators, in contact with heat reservoirs at different temperatures. The equilibrium counterpart of such model, the clock-model, exhibits three phases; a…

Statistical Mechanics · Physics 2019-08-20 Marc Suñé , Alberto Imparato

We investigate the effects of dichotomous noise added to a classical harmonic oscillator in the form of stochastic time-dependent gain and loss states, whose durations are sampled from two distinct exponential waiting time distributions.…

Statistical Mechanics · Physics 2016-11-01 Mirko Luković , Patrick Navez , Giorgos P. Tsironis , Theo Geisel

We investigate the emergence of an astonishingly long pre-thermal plateau in a classical phonon field, here a harmonic chain with on-site pinning. Integrability is broken by a weak anharmonic on-site potential with strength $\lambda$. In…

Statistical Mechanics · Physics 2020-05-13 François Huveneers , Jani Lukkarinen

We study spatial and temporal solitons in the $\mathcal{PT}$ symmetric coupler with gain in one waveguide and loss in the other. Stability properties of the high- and low-frequency solitons are found to be completely determined by a single…

Pattern Formation and Solitons · Physics 2015-06-05 N. V. Alexeeva , I. V. Barashenkov , Andrey A. Sukhorukov , Yuri S. Kivshar

We investigate the lattice dynamics and thermodynamics of nonmagnetic bcc vanadium as a function of temperature and pressure, using the first principles linear response linear-muffin-tin-orbital method. The calculated phonon density of…

Materials Science · Physics 2007-05-23 Xianwei Sha , R. E. Cohen

The problems with an emergent approach to quantum statistical mechanics are discussed and shown to follow from some of the same sources as those of quantum measurement. A wavefunction of an N atom solid is described in the ground and…

Quantum Physics · Physics 2015-02-24 Clifford Chafin

At high dissipation levels, vortex motion in a superconducting film has been observed to become unstable at a certain critical vortex velocity v*. At substrate temperatures substantially below Tc, the observed behavior can be accounted for…

Superconductivity · Physics 2009-11-11 James M. Knight , Milind N. Kunchur

We propose a new semiclassical approach based on the dynamical mean field theory to treat the interactions of electrons with local lattice fluctuations. In this approach the classical (static) phonon modes are treated exactly whereas the…

Strongly Correlated Electrons · Physics 2009-11-07 S. Blawid , A. Deppeler , A. J. Millis

Alloying is widely used as a means to fine-tune the properties of thermoelectric materials by reducing the lattice thermal conductivity. However, the effects of compositional variation on the lattice dynamics of alloy systems are not well…

Materials Science · Physics 2020-01-31 Jonathan M. Skelton