Related papers: The Hartree-Fock equations in modulation spaces
We prove new local and global well-posedness results for the cubic one-dimensional nonlinear Schr\"odinger equation in modulation spaces. Local results are obtained via multilinear interpolation. Global results are proven using conserved…
We investigate spaces of operators which are invariant under translations or modulations by lattices in phase space. The natural connection to the Heisenberg module is considered, giving results on the characterisation of such operators as…
We establish global well-posedness for both the defocusing and focusing complex-valued modified Korteweg--de Vries equations on the real line in modulation spaces $M_p^{s,2}(\mathbb{R})$, for all $1\leq p<\infty$ and $0\leq s<3/2-1/p$. We…
Modulation spaces have received considerable interest recently as it is the natural function spaces to consider low regularity Cauchy data for several nonlinear evolution equations. We establish global well-posedness for 3D…
We report Hartree-Fock (HF) based pseudopotentials suitable for plane-wave calculations. Unlike typical effective core potentials, the present pseudopotentials are finite at the origin and exhibit rapid convergence in a plane-wave basis;…
We study Cauchy problem for the Klein-Gordon (HNLKG), wave (HNLW) and Schr\"odinger (HNLS) equations with cubic convolution (Hartree type) nonlinearity. Some global well-posedness and scattering are obtained for the (HNLKG) and (HNLS) with…
A uniform derivation is presented of the self-consistent field equations in a finite basis set. Both restricted and unrestricted Hartree-Fock (HF) theory as well as various density functional (DF) approximations are considered. The unitary…
We investigate the existence of holomorphic Hartree-Fock solutions using a revised SCF algorithm. We use this algorithm to study the Hartree-Fock solutions for H$_{2}$ and H$_{4}^{2+}$ and report the emergence of holomorphic solutions at…
Hamiltonian and Schrodinger evolution equations on finite-dimensional projective space are analyzed in detail. Hartree-Fock (HF) manifold is introduced as a submanifold of many electron projective space of states. Evolution equations, exact…
This paper is concerned with the well-posedness analysis of the Hartree-Fock system modeling the time evolution of a quantum system comprised of fermions. We consider quantum states with finite mass and finite kinetic energy, and the…
We study the well-posedness of the reduced Hartree-Fock model for molecules and perfect crystals when taking into account a self-generated magnetic field. We exhibit a critical value $\alpha_c > 0$ such that, if the fine structure constant…
The multiconfigurational time-dependent Hartree-Fock equations are discussed and solved for a one-dimensional model of the Helium atom. Results for the ground state energy and two-particle density as well as the absorption spectrum are…
We prove the global existence of the solution for fractional Hartree equations with initial data in certain real interpolation spaces between $L^{2}$ and some kinds of new function spaces defined by fractional Schr\"odinger semigroup, which…
For arbitrarily large times $T>0$, we prove the uniform-in-$\hbar$ propagation of semiclassical regularity for the solutions to the Hartree$\unicode{x2013}$Fock equation with singular interactions of the form $V(x)=\pm\,|x|^{-a}$ where…
We consider the wave and Klein-Gordon equations on the real hyperbolic space $\mathbb{H}^{n}$ ($n \geq2$) in a framework based on weak-$L^{p}$ spaces. First, we establish dispersive estimates on Lorentz spaces in the context of…
Spin-projected Hartree-Fock is introduced as a particle-hole excitation ansatz over a symmetry-adapted reference determinant. Remarkably, this expansion has an analytic expression that we were able to decipher. While the form of the…
A new method is presented to reconstruct the potential of a quantum mechanical many-body system from observational data, combining a nonparametric Bayesian approach with a Hartree-Fock approximation. A priori information is implemented as a…
We investigate the well-posedness in the generalized Hartree equation $iu_t + \Delta u + (|x|^{-(N-\gamma)} \ast |u|^p)|u|^{p-2}u=0$, $x \in \mathbb{R}^N$, $0<\gamma<N$, for low powers of nonlinearity, $p<2$. We establish the local…
This paper proposes an efficient algorithm for solving the Hartree--Fock equation combining a multilevel correction scheme with an adaptive refinement technique to improve computational efficiency. The algorithm integrates a multilevel…
We investigate the Hartree-Fock solutions to H2 in a minimal basis. We note the properties of the solutions and their disappearance with geometry and propose a new method, Holomorphic Hartree-Fock theory, where we modify the SCF equations…