Related papers: Efficient $6j$ symbol evaluations for atomic calcu…
In the Large Hadron Collider, electron clouds have been observed to cause slow beam degradation in the form of beam lifetime reduction and slow emittance growth. We present a method for the simulation of such slow effects with arbitrarily…
Based on the effective-mass concept, we perform the Faddeev calculations for a low-lying spectrum of 3$\alpha$ states in $^{12}$C nucleus. A three-body potential is used to describe the known breaking of the 3$\alpha$-cluster structure in…
An expression for the effective Coulomb logarithm in one-component-plasma is proposed, which allows to extend the applicability of the classical formula for the self-diffusion coefficient to the strongly coupled regime. The proposed…
Atomic nuclei are composite systems, and they may be dynamically excited during nuclear reactions. Such excitations are not only relevant to inelastic scattering but they also affect other reaction processes such as elastic scattering and…
Symbolic computation, powered by modern computer algebra systems, has important applications in mathematical reasoning through exact deep computations. The efficiency of symbolic computation is largely constrained by such deep computations…
Coulomb dissociation is an especially simple and important reaction mechanism. Since the perturbation due to the electric field of the (target) nucleus is exactly known, firm conclusions can be drawn from such measurements. Electromagnetic…
Accurate and efficient methods to simulate nonadiabatic and quantum nuclear effects in high-dimensional and dissipative systems are crucial for the prediction of chemical dynamics in condensed phase. To facilitate effective development,…
A symbolic approach to decentralized set-valued state estimation and prediction for systems that admit a hybrid state machine representations is proposed. The decentralized computational scheme represents a conj unction of a finite number…
We perform transport model calculations for central collisions of mass 120 on mass 120 at laboratory beam energy in the range 20 MeV/nucleon to 200 MeV/nucleon. A simplified yet accurate method allows calculation of fluctuations in systems…
In this paper, we briefly discuss the dynamic and functional approach to computer symbolic tensor analysis. The ccgrg package for Wolfram Language/Mathematica is used to illustrate this approach. Some examples of applications are attached.
Structured matrices with symbolic sizes appear frequently in the literature, especially in the description of algorithms for linear algebra. Recent work has treated these symbolic structured matrices themselves as computational objects,…
The development of new electronic structure methods is a very time consuming and error prone process when done by hand. SpinAdaptedSecondQuantization is an open-source Julia package we have developed for working with automated electronic…
We evaluate the polarizabilities of the 5p_{1/2}, 6s, 6p_{1/2}, and 6p_{3/2} states of In using two different high-precision relativistic methods: linearized coupled-cluster approach where single, double and partial triple excitations of…
Equational unification of two terms consists of finding a substitution that, when applied to both terms, makes them equal modulo some equational properties. A narrowing-based equational unification algorithm relying on the concept of the…
In a recent paper (J. Chem. Theory. Comput., 2017, 13, 180-190) we proposed the Truncated Conjugate Gradient (TCG) approach to compute the polarization energy and forces in polarizable molecular simulations. The method consists in…
We perform coupled-cluster and diffusion Monte Carlo calculations of the energies of circular quantum dots up to 20 electrons. The coupled-cluster calculations include triples corrections and a renormalized Coulomb interaction defined for a…
We derive coupled-cluster equations for three-body Hamiltonians. The equations for the one- and two-body cluster amplitudes are presented in a factorized form that leads to an efficient numerical implementation. We employ low-momentum two-…
A simple three-body model of 6He is extended to include sd-continuum states in the picture in addition to the already investigated p-states. The role of different continuum components in the weakly bound nucleus 6He is studied by coupling…
Security-Constrained Unit Commitment (SCUC) is one of the most significant problems in secure and optimal operation of modern electricity markets. New sources of uncertainties such as wind speed volatility and price-sensitive loads impose…
A wide survey has been performed, concerning atomic binding energies and ionization energies used by well- known general purpose Monte Carlo codes and a few specialized electromagnetic models for track structure simulation. Validation…