Nonlinear Gap Modes in a 1D Alternating Bond Monatomic Lattice with Anharmonicity

We analytically study the nonlinear localized gap modes in a one-dimensional atomic chain with uniform atomic mass but two periodically alternating force constants between the nearest neighbors by means of a quasi-continuum approximation. This model simulates a row of atoms in the <111> direction of a diamond-structure type of crystals or molecular crystals with alternating double and single bonds. For this lattice system, we find that the harmonic plus quartic anharmonic terms of inter-site potential produce a new type of nonlinear localized gap modes with a slightly asymmetry distribution of atomic displacements. These localized gap modes are somewhat different from widely studied localized gap modes with a symmetry atomic displacement distribution in diatomic ion lattices.     

Oscillating Propagation of Kink in Nondissipative Frenkel-Kontorova Chain Due to External DC Force

We report the oscillating propagation of kink in a nondissipative Frenkel-Kontorova （FK） chain driven by external DC force, which is different from the usual propagation of localized modes with equal speed. When the kink moves in the opposite direction of the external DC force, the kink will be accelerated and the potential of the FK chain in the external force field is transformed to be the kinetic energy of the kink. If the kink reaches the boundary of the FK chain, the kink will be bounced back and moves in the opposite direction, then the kink will be decelerated gradually and the kinetic energy of the kink ＆ transformed to be the potential of the FK chain in the external force field. If the speed of the kink reaches zero, the kink will move in the opposite direction again driven by the external DC force, and a new oscillating cycle begins. Simulation result demonstrates exactly the transformation between the kinetic energy of the kink and the potential of the FK chain in the external force field. The interesting energy exchange is induced by the special topology of kinks, and other localized modes, such as breathers and envelope solitons, have no the interesting phenomenon.     

Directed transient long-range transport in a slowly driven Hamiltonian system of interacting particles

We study the Hamiltonian dynamics of a one-dimensional chain of linearly coupled particles in a spatially periodic potential which is subjected to a time-periodic mono-frequency external field. The average over time and space of the related force vanishes and hence, the system is effectively without bias which excludes any ratchet effect. We pay special attention to the escape of the entire chain when initially all of its units are distributed in a potential well. Moreover for an escaping chain we explore the possibility of the successive generation of a directed flow based on large accelerations. We find that for adiabatic slope-modulations due to the ac-field transient long-range transport dynamics arises whose direction is governed by the initial phase of the modulation. Most strikingly, that for the driven many particle Hamiltonian system directed collective motion is observed provides evidence for the existence of families of transporting invariant tori confining orbits in ballistic channels in the high-dimensional phase spaces.     

Quantum Solitons and Localized Modes in a One-Dimensional Lattice Chain with Nonlinear Substrate Potential

In the classical lattice theory, solitons and localized modes can exist in many one-dimensional nonlinear lattice chains, however, in the quantum lattice theory, whether quantum solitons and localized modes can exist or not in the one-dimensional lattice chains is an interesting problem. By using the number state method and the Hartree approximation combined with the method of multiple scales, we investigate quantum solitons and localized modes in a one-dimensional lattice chain with the nonlinear substrate potential. It is shown that quantum solitons do exist in this nonlinear lattice chain, and at the boundary of the phonon Brillouin zone, quantum solitons become quantum localized modes, phonons are pinned to the lattice of the vicinity at the central position j=j₀.     

Free energy and scalings for polymer translocation through a nanopore: A molecular dynamics simulation study combined with milestoning

Coarse-grained molecular dynamics simulations combined with milestoning method are used to study the stochastic process of polymer chain translocation though a nanopore. We find that the scalings for polymer translocation process (the chain is initialized with the first monomer in the nanopore) and for polymer escape process (the chain is initialized with the middle monomer in the nanopore) are different. The translocation process is mainly controlled by the entropic barrier, while the polymer escape process is driven by the effective force due to free energy difference.     

Localized modes in a one-dimensional sphalerite-structure lattice with anharmonicity

The nonlinear localized vibrational modes of a one-dimensional atomic chain with two periodically alternating masses and force constants are analytically investigated using a discrete multiple-scale expansion method. This model simulates a row of atoms in the <1 1 1>-direction of sphalerite, or zinc blende, crystals. Owing to the structural asymmetry, the vibrational amplitude is governed by a perturbed nonlinear Schr?dinger equation instead of the standard one found in one-dimensional lattices with two alternating masses but uniform force constant. Although the stationary localized modes with carrier wavevector at the Brillouin-zone boundary are similar to those of ionic lattices, the moving localized modes with wavevectors within the zone are different owing to the perturbation. The calculation shows that the height of the moving localized modes in this lattice dampens with time. Received 14 May 2001 and Received in final form 12 July 2001     

Computer simulation of nanoindentation into polymer films

We present computer simulations of nanoindentation into amorphous polymer films. The bulk polymer is treated through a united atom model in connection with molecular dynamics methods. The dynamics of the indenter is modeled as overdamped, such that the indentation velocity is proportional to the difference between the external force acting onto the tool and the resistance force built up in the polymer film. We concentrate on the initial, kinetic stage of the indentation process and give results for the motion of the indenter, the deformation field of the polymer film, the stress field, and the field of total monomer energy. We propose an effective coefficient as a new measure for the resistivity of a surface against indentation. Its value can be determined in an experiment with constant indentation velocity. In addition, we investigate the free drift behavior when the external driving force has been set to zero and the tool is expelled from the polymer film. For different polymer chain lengths, the tool’s motion is exponential in time and we determine the relaxation scale.     

一维金刚石结构晶格的非线性局域模

用多重尺度法研究了质量均匀相互作用力交替变化的原子链形成的非线性局域振动模式,这 种原子链模拟了金刚石结构晶格沿〈111〉晶向或一维分子链的振动,通过多重尺度展开分 析得出,原子位移分布服从微扰的非线性Schrdinger方程,求得了相应的定态解和传播解 ,其结果与相互作用力相同质量交替分布的另一种形式的一维双原子晶格的结果有所不同, 其原因是金刚石结构晶格的对称性相对差些. 关键词： 金刚石结构 非线性局域模 多重尺度法     

外力驱动作用下高分子链在表面吸附性质的计算机模拟

采用退火法模拟研究受外力F驱动的高分子链在吸引表面的吸附特性.通过高分子链的平均表面接触数〈M〉与温度T之间的关系计算临界吸附温度T_c,并发现T_c随着F的增加而减小;进而通过高分子链的均方回转半径分析外力驱动作用对高分子链构象的影响,并从回转半径极小值或者垂直外力方向的y和z分量的变化交叉校验临界吸附点T_c.模拟计算了处于吸附状态的高分子链随着外力F的增加是否会发生吸附状态到脱附状态的相变以及发生相变所需施加的外力是否由温度所决定.模拟结果表明:两种不同温度下高分子链的吸附性质和构象性质受外力驱动作用而产生不同现象,在温度区间T*_cTT_c时会发生脱附现象,而在TT*_c时不会发生脱附现象.     

Intrinsic localized modes and nonlinear impurity modes in curved Fermi-Pasta-Ulam chain

We explore the nature of intrinsic localized modes (ILMs) in a curved Fermi-Pasta-Ulam (FPU) chain and the effects of geometry and second-neighbor interaction on the localization and movability properties of such modes. We determine analytically the structure of the localized modes induced by an isotopic light-mass impurity in this chain. We further demonstrate that a nonlinear impurity mode may be treated as a bound state of an ILM with the impurity.      

非线性Rosen-Zener跃迁

研究了非线性两模系统的Rosen-Zener跃迁.在绝热近似下，对基态能相同的两个模态，非线性相互作用使原子表现出强烈的集体行为，它们总是趋向于聚集到同一个模态上.因此外场的绝热调制能够把原子从一种模式彻底转移到另一种模式上.在经典相空间中，可以成功地解释该现象.提议利用现有的玻色爱因斯坦凝聚实验观测这一效应. 关键词： Bose-Einstein凝聚 Rosen-Zener跃迁 Rabi振荡 受激Raman绝热暗通道     

Distribution of escape times for a deterministically driven bistable system

In this paper, we analyze the sequence of escape times for a particle in a symmetric double-well potential coupled to a chain of monodimensional oscillators and we find that, in some range of energies, the probability of escape exhibits the multimodal form that is characteristic of bistable systems driven by a periodic signal embedded in noise. We identify two different modes contributing to the overall hopping dynamics of the particle, each one having a definite dependence on the energy of the chain. Those findings suggest a model for internal fluctuations that could be useful in the study of some problems of interest in physics and biology.     

Stabilizing stick-slip friction

Even the most regular stick-slip frictional sliding is always stochastic, with irregularity in both the intervals between slip events and the sizes of the associated stress drops. Applying small-amplitude oscillations to the shear force, we show, experimentally and theoretically, that the stick-slip periods synchronize. We further show that this phase locking is related to the inhibition of slow rupture modes which forces a transition to fast rupture, providing a possible mechanism for observed remote triggering of earthquakes. Such manipulation of collective modes may be generally relevant to extended nonlinear systems driven near to criticality.     

Quantum tunneling at zero temperature in the strong friction regime

In the large damping limit we derive a Fokker-Planck equation in configuration space (the so-called Smoluchowski equation) describing a Brownian particle immersed into a thermal environment and subjected to a nonlinear external force. We quantize this stochastic system and survey the problem of escape over a double-well potential barrier. Our finding is that the quantum Kramers rate does not depend on the friction coefficient at low temperatures; i.e., we predict a superfluidity phenomenon in overdamped open systems. Moreover, at zero temperature we show that the quantum escape rate does not vanish in the strong friction regime. This result, therefore, is in contrast with the work by Ankerhold et al. [Phys. Rev. Lett. 87, 086802 (2001)]] in which no quantum tunneling is predicted at zero temperature.     

Nonequilibrium invariant measure under heat flow

We provide an explicit representation of the nonequilibrium invariant measure for a chain of harmonic oscillators with conservative noise in the presence of stationary heat flow. By first determining the covariance matrix, we are able to express the measure as the product of Gaussian distributions aligned along some collective modes that are spatially localized with power-law tails. Numerical studies show that such a representation applies also to a purely deterministic model, the quartic Fermi-Pasta-Ulam chain.     

Electron-magnon coupling and nonlinear tunneling transport in magnetic nanoparticles

We present a theory of single-electron tunneling transport through a ferromagnetic nanoparticle in which particle-hole excitations are coupled to spin collective modes. The model employed to describe the interaction between quasiparticles and collective excitations captures the salient features of a recent microscopic study. Our analysis of nonlinear quantum transport in the regime of weak coupling to the external electrodes is based on a rate-equation formalism for the nonequilibrium occupation probability of the nanoparticle many-body states. For strong electron-boson coupling, we find that the tunneling conductance as a function of bias voltage is characterized by a large and dense set of resonances. Their magnetic field dependence in the large-field regime is linear, with slopes of the same sign. Both features are in agreement with recent tunneling experiments.     

Confinement-driven translocation of a flexible polymer

We consider the escape of a flexible, self-avoiding polymer chain out of a confined geometry. By means of simulations, we demonstrate that the translocation time can be described by a simple scaling law that exhibits a nonlinear dependence on the degree of polymerization and that is sensitive to the nature of the confining geometry. These results contradict earlier predictions but are in agreement with recently confirmed geometry-dependent expressions for the free energy of confinement.     

Free and forced vibration analysis of a nonlinear system with cyclic symmetry: Application to a simplified model

This work program is devoted to studying the nonlinear dynamics of a structure with cyclic symmetry under conditions of geometric nonlinearity, through the use of the harmonic balance method (HBM). In order to study the influence of nonlinearity due to the large deflection of blades, a simplified model has been developed. This approach leads to a system of linearly coupled, second-order nonlinear differential equations, in which nonlinearity appears via cubic terms. Periodic solutions, in both the free and forced cases, are sought by applying HBM coupled with an arc-length continuation method. Solution stability has been investigated using Floquet's theorem. In addition to featuring similar and nonsimilar nonlinear modes, the unforced system is known to contain localized nonlinear modes that arise from branching point bifurcation at certain vibration amplitudes. In the forced case, these nonlinear modes give rise to a complex dynamic behavior. Many bifurcations can take place, thus leading to strong or weak localization that may or may not be stable. In this study, special attention has been paid to the influence of excitation on dynamic responses. Several cases of excitation have been analyzed herein: localized excitation, and low-engine-order excitation. In the case of low-engine-order excitation, sensitivity of the response to a perturbation of this excitation type has been investigated, and it has been shown that for a localized, or sufficiently detuned excitation, several solutions can coexist, some of which are represented by closed curves in the Frequency-Amplitude domain. These various solutions overlap when increasing the force amplitude, leading to forced nonlinear localization. Because closed curves are not tied up with the basic nonlinear solution, they can easily be overlooked. In this study, they have been calculated using a sequential continuation with the force amplitude as a parameter.     

Spatiotemporal pulses in a liquid crystal optical oscillator

A nonlinear optical medium results by the collective orientation of liquid crystal molecules tightly coupled to a transparent photoconductive layer. We show that such a medium can give a large gain; thus, if inserted in a ring cavity, it results in an unidirectional optical oscillator. We report new dynamical regimes characterized by the generation of spatiotemporal pulses, localized in three dimensions and arising from the random superposition of many longitudinal and transverse modes with different frequencies.     

Stability and instability of nonlinear defect states in the coupled mode equations—Analytical and numerical study

Coupled backward and forward wave amplitudes of an electromagnetic field propagating in a periodic and nonlinear medium at Bragg resonance are governed by the nonlinear coupled mode equations (NLCME). This system of PDEs, similar in structure to the Dirac equations, has gap soliton solutions that travel at any speed between 0 and the speed of light. A recently considered strategy for spatial trapping or capture of gap optical soliton light pulses is based on the appropriate design of localized defects in the periodic structure. Localized defects in the periodic structure give rise to defect modes, which persist as nonlinear defect modes as the amplitude is increased. Soliton trapping is the transfer of incoming soliton energy to nonlinear defect modes. To serve as targets for such energy transfer, nonlinear defect modes must be stable. We therefore investigate the stability of nonlinear defect modes. Resonance among discrete localized modes and radiation modes plays a role in the mechanism for stability and instability, in a manner analogous to the nonlinear Schrödinger/Gross-Pitaevskii (NLS/GP) equation. However, the nature of instabilities and how energy is exchanged among modes is considerably more complicated than for NLS/GP due, in part, to a continuous spectrum of radiation modes which is unbounded above and below. In this paper we (a) establish the instability of branches of nonlinear defect states which, for vanishing amplitude, have a linearization with eigenvalues embedded within the continuous spectrum, (b) numerically compute, using Evans function, the linearized spectrum of nonlinear defect states of an interesting multiparameter family of defects, and (c) perform direct time-dependent numerical simulations in which we observe the exchange of energy among discrete and continuum modes.