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Amorphous phosphorus (a-P) has long attracted interest because of its complex atomic structure, and more recently as an anode material for batteries. However, accurately describing and understanding a-P at the atomistic level remains a…
Starting from the $\pi$-electron Pariser-Parr-Pople (PPP) Hamiltonian which includes both strong electron-phonon and electron-electron interactions, we propose some strongly correlated wave functions of increasing quality for the ground…
We have adapted Coupled Escape Probability, a new exact method of solving radiative transfer problems, for use in asymmetrical spherical situations. Our model is intended specifically for use in modeling optically thick cometary comae,…
The analytic gradient theory for both iterative and non-iterative coupled-cluster approximations that include connected quadruple excitations is presented. These methods include, in particular, CCSDT(Q), which is an analog of the well-known…
In the molecular quantum chemistry community, coupled-cluster (CC) methods are well-recognized for their systematic convergence and reliability. The extension of the theory to extended systems has been comparably recent, so that…
We numerically examine divergences of the total energy in metallic systems of approximate many-body theories using Hartree--Fock as a reference, including perturbative (M\oller-Plesset, MP), coupled cluster (CC) and configuration…
Highly accurate methods such as coupled cluster (CC) techniques can be used for periodic systems within the framework of the method of increments. Its extension to low-dimensional conducting system is considered. To demonstrate the…
We present an extension of constrained-path auxiliary-field quantum Monte Carlo (CP-AFQMC) for the treatment of correlated electronic systems coupled to phonons. The algorithm follows the standard CP-AFQMC approach for description of the…
We study an optical response of a system of two parallel close metallic cylinders having nanoscale dimensions. Surface plasmon excitation in the gap between the cylinders are specifically analyzed. In particular, resonance frequencies and…
We propose that the interaction between the axionlike particles (ALPs) and photons can be a possible origin of optical circular polarization (CP) in blazars. Given that there is no definite detection of optical CP at $\sim0.1\%$ level, a…
We present an analytical proof and numerical demonstrations of the equivalence of the correlation energy from particle-particle random phase approximation (pp-RPA) and ladder-couple-cluster-doubles (ladder-CCD). These two theories reduce to…
In periodic media gap solitons with frequencies inside a spectral gap but close to a spectral band can be formally approximated by a slowly varying envelope ansatz. The ansatz is based on the linear Bloch waves at the edge of the band and…
We simulated the 3-band Hubbard model using the Constrained Path Monte Carlo (CPMC) method in search for a possible superconducting ground state. The CPMC is a ground state method which is free of the exponential scaling of computing time…
Recoupling matrix elements are evaluated, in the harmonic oscillator approximation, for all possible angular and radial excitations in processes where quarks recombine. A diagrammatic representation is given. Their use is demonstrated in…
We investigate a charge-parity (CP) odd axion-like particle (ALP) featuring simultaneous CP-conserving ($a F_{\mu\nu}\tilde{F}^{\mu\nu}$) and CP-violating ($a F_{\mu\nu}F^{\mu\nu}$) ALP-photon interactions at future lepton colliders. The…
Ayyer and Linusson studied correlations in the multispecies TASEP on a ring (Trans AMS, 2017) using a combinatorial analysis of the multiline queues construction defined by Ferrari and Martin (AOP, 2008). It is natural to explore whether an…
We present an analysis of the pairing resonances observed in photo-double-ionization studies of CnHm aromatic molecules with multiple benzene-like rings. The analysis, which is based on the Coulomb pairing model, is applied to naphthalene,…
We perform a model-independent global fit to all germane and updated $b \to s \ell \ell$ ($\ell=e,\,\mu$) data assuming new physics couplings to be complex. Under the approximation that new physics universally affects muon and electron…
We study a prototypical model of two coupled two-level systems, where the competition between coherent and dissipative coupling gives rise to a rich phenomenology. In particular, we analyze the case of asymmetric coupling, as well as the…
We consider a model of two (fully) compact polymer chains, coupled through an attractive interaction. These compact chains are represented by Hamiltonian paths (HP), and the coupling favors the existence of common bonds between the chains.…