Related papers: Correlated Electron-Nuclear Dynamics with Conditio…
We obtain analytic solution of the time-independent Schrodinger equation in two dimensions for a charged particle moving in the field of an electric quadrupole. The solution is written as a series in terms of special functions that support…
We propose an alternative to the usual time--independent Born--Oppenheimer approximation that is specifically designed to describe molecules with non--symmetrical hydrogen bonds. In our approach, the masses of the hydrogen nuclei are scaled…
The combined quantum electron-nuclear dynamics is often associated with the Born-Huang expansion of the molecular wave function and the appearance of nonadiabatic effects as a perturbation. On the other hand, native multicomponent…
A nonadiabatic scheme for the description of the coupled electron and nuclear motions in the ozone molecule was proposed recently. An initial coherent nonstationary state was prepared as a superposition of the ground state and the excited…
We derive a microscopic version of the successful phenomenological hydrodynamic model of Bohr-Davydov-Faessler-Greiner for collective rotation-vibration motion of an axially symmetric deformed nucleus. The derivation is not limited to small…
The nonrelativistic quantum dynamics of a spinless charged particle in the presence of the Aharonov--Bohm potential in curved space is considered. We chose the surface as being a cone defined by a line element in polar coordinates. The…
This work investigates the motion of a non-relativistic charged particle within the spacetime of a global monopole. We introduce the Schr\"odinger equation to describe the particle's motion with two interactions by considering the Kratzer…
A fundamental belief is that the formulism of relativistic quantum mechanics equations (RQMEs) should remain in low momentum motion. However, it is found that some formulas from RQMEs were lost in Schr\"odinger equation. For example, a free…
A charged particle (electron or hole) confined in nanorod of strongly prolate ellipsoidal shape is considered. The effective-mass Schr\"odinger equation is solved in prolate spheroidal coordinates and asymptotically exact expressions for…
A number of non-Markovian stochastic Schr\"odinger equations, ranging from the numerically exact hierarchical form towards a series of perturbative expressions sequentially presented in an ascending degrees of approximations are revisited…
The universal theory of weakly nonlinear wave packets given by the nonlinear Schr\"odinger equation is revisited. In the limit where the group and phase velocities are very close together, a multiple scale analysis carried out beyond all…
The theoretical foundations of quantum mechanics and de Broglie-Bohm mechanics are analyzed and it is shown that both theories employ a formal approach to microphysics. By using a realistic approach it can be established that the internal…
In this paper, we present quantum algorithms for a class of highly-oscillatory transport equations, which arise in semiclassical computation of surface hopping problems and other related non-adiabatic quantum dynamics, based on the…
We present a new formulation of the correlated electron-ion dynamics (CEID) scheme, which systematically improves Ehrenfest dynamics by including quantum fluctuations around the mean-field atomic trajectories. We show that the method can…
It is shown that evolution of an open quantum system can be exactly described in terms of wave function which obeys Schrodinger equation with randomly varying parameters whose statistics is universally determined by separate dynamics of the…
This work completes the construction of purely algebraic version of the theory of non-linear quantum chemistry methods. It is shown that at the heart of these methods there lie certain algebras close in their definition to the well-known…
Solutions of the Schr\"odinger equation by spanning the wave function is a complete basis is a common practice is many-body interacting systems. We shall study the case of a two-dimensional quantum system composed by two interacting…
In the Kirchhoff model of a biopolymer, conformation dynamics can be described in terms of solitary waves, for certain special cross-section asymmetries. Applying this to the problem of electron transport, we show that the quantum effective…
The exact factorization of an electron-nuclear wavefunction [A. Abedi, N. T. Maitra, and E. K. U. Gross, Phys. Rev. Lett. 105, 123002 (2010)] allows us to define the rigorous nuclear time-dependent Schr\"{o}dinger equation (TDSE) with a…
In molecular reactions at the microscopic level the appearance of resonances has an important influence on the reactivity. It is important to predict when a bound state transitions into a resonance and how these transitions depend on…