Related papers: On Factorization of Molecular Wavefunctions
It was recently shown that the exact factorization of the electron-nuclear wavefunction allows the construction of a Schr\"odinger equation for the electronic system, in which the potential contains exactly the effect of coupling to the…
It was recently shown that the exact potential driving the electron's dynamics in enhanced ionization of H$_2^+$ can have large contributions arising from dynamical electron-nuclear correlation, going beyond what any electrostatics-based…
Both the additional non-linear term in the Schr\"odinger equation and the additional non-Hamiltonian term in the von Neumann equation, proposed to ensure localisation and decoherence of macro-objects, resp., contain the same Newtonian…
A Fourier transformation in a fractional dimensional space of order $\la$ ($0<\la\leq 1$) is defined to solve the Schr\"odinger equation with Riesz fractional derivatives of order $\a$. This new method is applied for a particle in a…
We find approximate analytical presentation of the solutions $\Psi(r_1, r_2, r_{12})$ of Schr\"odinger equation for two-electron system bound by the nucleus, in the space region $r_{1,2}=0$ and $r_{12}=0$ that are of great importance for a…
The factorization method was introduced by Schroedinger in 1940. Its use in bound-state problems is widely known, including in supersymmetric quantum mechanics; one can create a factorization chain, which simultaneously solves a sequence of…
Position scaling-eigenfunctions are generated by transforming compactly supported orthonormal scaling functions and utilized for faster alternatives to maximally localized Wannier functions (MLWFs). The position scaling-eigenfunctions are…
A covariant non-local extention if the stationary Schr\"odinger equation is presented and it's solution in terms of Heisenbergs's matrix quantum mechanics is proposed. For the special case of the Riesz fractional derivative, the calculation…
The Schr\"odinger equation relates the electron wavefunction and the electric potential, which are emergent physical quantities. At that emergent level, the Schr\"odinger equation is either postulated as a principle of quantum physics or…
The applicability of the factorization method is extended to the case of quantum fractional-differential Hamiltonians. In contrast with the conventional factorization, it is shown that the `factorization energy' is now a…
In scattering theory, the squared relative wave function $|\phi({\bf q},{\bf r})|^2$ is often interpreted as a weight, due to final-state interactions, describing the probability enhancement for emission with asymptotic relative momentum…
Low-lying shell model states may be approximated accurately by a sum over products of proton and neutron states. The optimal factors are determined by a variational principle and result from the solution of rather low-dimensional eigenvalue…
A review of some recently developed methods of calculating multiple differential cross-sections of photoionization and electron impactionization of atoms and molecules having two active electrons is presented. The methods imply original…
Schwinger's formalism in quantum field theory can be easily implemented in the case of scalar theories in $D$ dimension with exponential interactions, such as $\mu^D\exp(\alpha\phi)$. In particular, we use the relation $$…
The Exact Factorization (EF) theory aims at the separation of the nuclear and electronic degrees of freedom in the many-body (MB) quantum mechanical problem. Being formally equivalent to the solution of the MB Schr\"{o}dinger equation, EF…
The evolution of the centre-of-mass wave-function for a mesoscopic particle according to the Schr\"odinger-Newton equation can be approximated by a harmonic potential, if the wave-function is narrow compared to the size of the particle. It…
A description of scalar charged particles, based on the Feshbach-Villars formalism, is proposed. Particles are described by an object that is a Wigner function in usual coordinates and momenta and a density matrix in the charge variable. It…
Based on the Caputo fractional derivative the classical, non relativistic Hamiltonian is quantized leading to a fractional Schroedinger type wave equation. The free particle solutions are localized in space. Solutions for the infinite well…
Accurate numerical solutions for the Schr\"odinger equation are of utmost importance in quantum chemistry. However, the computational cost of current high-accuracy methods scales poorly with the number of interacting particles. Combining…
We put forward an interpretation of scalar quantum field theory as relativistic quantum mechanics by curing well known problems related to locality. A probabilistic interpretation of quantum field theory similar to quantum mechanics is…