Search results for "Energy functional"
showing 10 items of 34 documents
Influence of semiconducting electrodes on properties of thin ferroelectric films
2005
The influence of semiconducting electrodes on the properties of thin ferroelectric films is considered within the framework of the phenomenological Ginzburg-Landau theory. The contribution of the electric field produced by charges in the electrodes allowing for the screening length of the carriers is included in the functional of the free energy and so in the Euler-Lagrange equation for the film's polarization. Application of the variational method to the solution of this equation allows the transformation of the free energy functional into a conventional type of free energy with renormalized coefficients. The obtained dependence of the coefficients on the film thickness, temperature, elect…
Light scattering in inhomogeneous Tomonaga-Luttinger liquids
2012
We derive the dynamical structure factor for an inhomogeneous Tomonaga-Luttinger liquid as can be formed in a confined strongly interacting one-dimensional gas. In view of current experimental progress in the field, we provide a simple analytic expression for the light-scattering cross section, requiring only the knowledge of the density dependence of the ground-state energy, as they can be extracted e.g. from exact or Quantum Monte Carlo techniques, and a Thomas-Fermi description. We apply the result to the case of one-dimensional quantum bosonic gases with dipolar interaction in a harmonic trap, using an energy functional deduced from Quantum Monte Carlo computations. We find an universal…
Perturbative triples corrections in state-specific multireference coupled cluster theory
2010
We formulated and implemented a perturbative triples correction for the state-specific multireference coupled cluster approach with singles and doubles suggested by Mukherjee and co-workers, Mk-MRCCSD [Mol. Phys. 94, 157 (1998)]. Our derivation of the energy correction [Mk-MRCCSD(T)] is based on a constrained search for stationary points of the Mk-MRCC energy functional together with a perturbative expansion with respect to the appearing triples cluster operator. The Lambda-Mk-MRCCSD(T) approach derived in this way consists in (1) a correction to the off-diagonal matrix elements of the effective Hamiltonian which is unique to coupled cluster methods based on the Jeziorski-Monkhorst ansatz, …
Effect of three-body cluster on the healing properties of the Jastrow Correlation function
1973
A variational equation for the Jastrow Correlation function is derived from the energy functional expanded up to three-body cluster terms. The asymptotic behaviour of this nonlinear equation is studied. The solutions show a healing at least of the type cos(tαr)/r2. The influence of higher cluster contributions is studied. Finally, it is discussed, how one can reduce the many-body cluster contributions to healing conditions to be used in the two-body cluster treatment.
FINITE-RANGE SEPARABLE PAIRING INTERACTION WITHIN NEW N[sup 3]LO DFT APPROACH
2011
For over four decades, the Skyrme functional within various parametrizations has been used to calculate nuclear properties. In the last few years there was a number of attempts to improve its performance and introduce generalized forms. In particular, the most general phenomenologi‐cal quasi‐local energy density functional, which contains all combinations of density, spin‐density, and their derivatives up to the sixth order (N3LO), was proposed in reference [1]. Since in the phe‐nomenological functional approaches the particle‐particle (pp) interaction channel is treated independently from the particle‐hole (ph) channel, there remains a question of what pairing interaction is suitable to us…
Existence and orbital stability of standing waves to nonlinear Schr��dinger system with partial confinement
2018
We are concerned with the existence of solutions to the following nonlinear Schr\"odinger system in $\mathbb{R}^3$: \begin{equation*} \left\{ \begin{aligned} -\Delta u_1 + (x_1^2+x_2^2)u_1&= \lambda_1 u_1 + \mu_1 |u_1|^{p_1 -2}u_1 + \beta r_1|u_1|^{r_1-2}u_1|u_2|^{r_2}, \\ -\Delta u_2 + (x_1^2+x_2^2)u_2&= \lambda_2 u_2 + \mu_2 |u_2|^{p_2 -2}u_2 +\beta r_2 |u_1|^{r_1}|u_2|^{r_2 -2}u_2, \end{aligned} \right. \end{equation*} under the constraint \begin{align*} \int_{\mathbb{R}^3}|u_1|^2 \, dx = a_1>0,\quad \int_{\mathbb{R}^3}|u_2|^2 \, dx = a_2>0, \end{align*} where $\mu_1, \mu_2, \beta >0, 2 1, r_1 + r_2 < \frac{10}{3}$. In the system, the parameters $\lambda_1, \lambda_2 \in \R$ are unknown …
Nuclear density functional theory with a semi-contact 3-body interaction
2015
International audience; Theories combining nuclear density functional approach (DFT) and effects beyond the independent particle/quasi-particle limit have attracted much attention recently. In particular, such theories, generically referred as “beyond mean-field” (BMF) seem unavoidable to account for both single-particle effects and complex quantum internal phenomena in nuclear finite many-body nuclear systems. It has been realized recently that BMF theories might lead to specific difficulties when applied within the nuclear DFT context. An example is the appearance of divergences in configuration mixing approaches. A short summary of the difficulties is given here. One source of problem is…
On the Energy of Distributions, with Application to the Quaternionic Hopf Fibrations
2001
The energy of an oriented q-distribution ? in a compact oriented manifold M is defined to be the energy of the section of the Grassmannian manifold of oriented q-planes in M induced by ?. In the Grassmannian, the Sasaki metric is considered. We show here a condition for a distribution to be a critical point of the energy functional. In the spheres, we see that Hopf fibrations \(\) are critical points. Later, we prove the instability for these fibrations.
Morse-Smale index theorems for elliptic boundary deformation problems.
2012
AbstractMorse-type index theorems for self-adjoint elliptic second order boundary value problems arise as the second variation of an energy functional corresponding to some variational problem. The celebrated Morse index theorem establishes a precise relation between the Morse index of a geodesic (as critical point of the geodesic action functional) and the number of conjugate points along the curve. Generalization of this theorem to linear elliptic boundary value problems appeared since seventies. (See, for instance, Smale (1965) [12], Uhlenbeck (1973) [15] and Simons (1968) [11] among others.) The aim of this paper is to prove a Morse–Smale index theorem for a second order self-adjoint el…
Large systems of path-repellent Brownian motions in a trap at positive temperature
2006
We study a model of $ N $ mutually repellent Brownian motions under confinement to stay in some bounded region of space. Our model is defined in terms of a transformed path measure under a trap Hamiltonian, which prevents the motions from escaping to infinity, and a pair-interaction Hamiltonian, which imposes a repellency of the $N$ paths. In fact, this interaction is an $N$-dependent regularisation of the Brownian intersection local times, an object which is of independent interest in the theory of stochastic processes. The time horizon (interpreted as the inverse temperature) is kept fixed. We analyse the model for diverging number of Brownian motions in terms of a large deviation princip…