Related papers: Two-electron wavefunctions are matrix product stat…
We consider an electrostatically induced square lattice of quantum dots and study the role of electron-electron correlations in the resulting electronic features of the system. We utilize the Wannier functions methodology in order to…
We find that a large number of parameters are used to create the correct fractions. The parameters used are, \nu, 1-\nu,\nu^*,\bar n, n, p and \bar p. Therefore, the predicted fractions need not be having the correct origin. The wave…
We construct model wavefunctions for the collective modes of fractional quantum Hall systems. The wavefunctions are expressed in terms of symmetric polynomials characterized by a root partition and a "squeezed" basis, and show excellent…
A new electronic structure model is developed in which the ground state energy of a molecular system is given by a Hartree-Fock-like expression with parametrized one- and two-electron integrals over an extended (minimal + polarization) set…
The energy spectrum for three species of identical fermionic atoms close to a Feshbach resonance is computed by use of a nonperturbative flow equation. Already a simple truncation shows that for large scattering length $|a|$ the lowest…
The family of solutions to the Dirac equation for an electron moving in an electromagnetic lattice with the chiral structure created by counterpropagating circularly polarized plane electromagnetic waves is obtained. At any nonzero…
The exact form of the kinetic energy functional has remained elusive in orbital-free models of density functional theory (DFT). This has been the main stumbling block for the development of a general-purpose framework on this basis. Here,…
We present an interface of the wavefunction-based quantum-chemical software CFOUR to the multiscale modeling framework MiMiC. Electrostatic embedding of the quantummechanical (QM) part is achieved by analytic evaluation of one-electron…
In the framework of the study of helium-like atomic systems possessing the collinear configuration, we propose a simple method for computing compact but very accurate wave functions describing the relevant $S$ state. It is worth noting that…
We perform the energy minimization of the paired composite fermion (CF) wave functions, proposed by M\"oller and Simon (MS) [PRB 77, 075319 (2008)] and extended by Yutushui and Mross (YM) [PRB 102, 195153 (2020)], where the energy is…
A method is suggested to build simple multiconfigurational wave functions specified uniquely by an energy cutoff $\Lambda$. These are constructed from a model space containing determinants with energy relative to that of the most stable…
The gap equation for fermions in a version of thermal QED in three dimensions is studied numerically in the Schwinger-Dyson formalism. The interest in this theory has been recently revived since it has been proposed as a model of…
Despite fermion doubling, a two-dimensional quasi-relativistic spin-1/2 system can still lead to true fractionalization of electrical charge, when a massive ordered phase supports a "half-vortex". Such topological defect is possible when…
Two-dimensional moir\'e materials have emerged as the most versatile platforms for realizing quantum phases of electrons. Here, we explore the stability origins of correlated states in WSe2/WS2 moir\'e superlattices. We find that ultrafast…
We present an example of an electronic wavefunction with maximally entangled MPS representation, in the sense that the bond dimension is maximal and cannot be lowered by any re-ordering of the underlying one-body basis. Our construction…
Correlator product states (CPS) are a class of tensor network wavefunctions applicable to strongly correlated problems in arbitrary dimensions. Here, we present a method for optimizing and evaluating the energy of the CPS wavefunction that…
The choice of molecular orbitals is decisive in configuration interaction calculations. In this letter, a democratic description of the ground and excited states follows an orthogonally constrained orbitals optimization to produce…
Efficiently recovering dynamic correlation in strongly correlated systems without incurring prohibitive computational costs remains a central challenge in quantum chemistry. In this Perspective, we review and benchmark methods capable of…
Extracting molecular properties from a wave function can be done through the linear response (LR) formalism or, equivalently, the equation of motion (EOM) formalism. For a simple model system, He in a 6-31G basis, it is here shown that…
We discuss the topology of the wavefunctions of two-dimensional time-reversal symmetric superconductors. We consider (a) the planar state, (b) a system with broken up-down reflection symmetry, and (c) a system with general spin-orbit…