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Complex transition density can be constructed by a nuclear structure model with a complex basis and/or complex coefficient. In general, the complex transition density is converted to the real one with phase factor. In this study, we apply…

Nuclear Theory · Physics 2022-05-26 T. Furumoto

We employ the time-dependent Hartree-Fock (TDHF) method to study various aspects of the reactions utilized in searches for superheavy elements. These include capture cross-sections, quasifission, prediction of $P_{\mathrm{CN}}$, and other…

Nuclear Theory · Physics 2016-04-12 A. S. Umar , V. E. Oberacker

This paper presents some absorbing boundary conditions (ABC) for simulations based on the time-dependent density-functional theory (TDDFT). The boundary conditions are expressed in terms of the elements of the density-matrix, and it is…

Numerical Analysis · Mathematics 2019-05-01 Xiantao Li

The current generation of covariant mean-field models has had many successes in calculations of bulk observables for medium to heavy nuclei, but there remain many open questions. New challenges are confronted when trying to systematically…

Nuclear Theory · Physics 2017-01-25 R. J. Furnstahl

Combining images with different exposure settings are of prime importance in the field of computational photography. Both transform domain approach and filtering based approaches are possible for fusing multiple exposure images, to obtain…

Image and Video Processing · Electrical Eng. & Systems 2021-10-04 Vivek Ramakarishnan , Dnyaneshwar Jageshwar Pete

The application of methods of time-dependent density functional theory (TDDFT) to systems of qubits provided the interesting possibility of simulating an assigned Hamiltonian evolution by means of an auxiliary Hamiltonian having different…

Quantum Physics · Physics 2012-03-08 Diego de Falco , Dario Tamascelli

Fusion cross sections of light nuclei are calculated by a complex potential and taking into account of conservation of angular momentum and parity. The nuclear potential is assumed to be as simple as a spherical complex square well with a…

Nuclear Theory · Physics 2018-10-16 T. Koohrokhi , A. M. Izadpanah , S. K. Hosseini

Conical intersections are central to the description of photophysics and photochemistry. Nevertheless, in non-adiabatic molecular dynamics simulations, they are fundamentally challenging for single-reference electronic structure methods.…

Chemical Physics · Physics 2026-04-23 Federico Rossi , Tommaso Giovannini , Henrik Koch

Background: At energies near the Coulomb barrier, capture reactions in heavy-ion collisions result either in fusion or in quasifission. The former produces a compound nucleus in statistical equilibrium, while the second leads to a…

Nuclear Theory · Physics 2016-05-12 A. S. Umar , V. E. Oberacker , C. Simenel

The process of fusion of complex nuclei is of significant interest as an example of the collective nuclear motion of large amplitude as well as a route for synthesis of new superheavy chemical elements. This process is accompanied by the…

Nuclear Theory · Physics 2023-05-23 I. I. Gontchar , M. V. Chushnyakova

Density functional theory (DFT) calculation has had huge success as a tool capable of predicting important physical and chemical properties of condensed matter systems. We calculate the electric dipole moment of a molecule by using the…

Chemical Physics · Physics 2019-03-12 Byeong June Min

The process of carbon burning is vital to understanding late stage stellar evolution of massive stars and the conditions of certain supernovae. Carbon burning is a complex problem, involving quantum tunnelling and nuclear molecular states.…

Nuclear Theory · Physics 2025-09-18 Grant Close , Paul Stevenson , Alexis Diaz-Torres

The Kohn-Sham approach to time-dependent density-functional theory (TDDFT) can be formulated, in principle exactly, by invoking the force-balance equation for the density, which leads to an explicit expression for the exchange-correlation…

Chemical Physics · Physics 2021-09-15 Walter Tarantino , Carsten A. Ullrich

Background: Near-barrier fusion can be strongly affected by the coupling between relative motion and internal degrees of freedom of the collision partners. The time-dependent Hartree-Fock (TDHF) theory and the coupled-channels (CC) method…

Nuclear Theory · Physics 2013-12-09 C. Simenel , M. Dasgupta , D. J. Hinde , E. Williams

We demonstrate the capabilities of time-dependent density functional theory (TDDFT) for strong-field, short wavelength (soft X-ray) physics, as compared to a formalism based on rate equations. We find that TDDFT provides a very good…

Fusion - fission probabilities in the synthesis of heaviest elements are discussed in the context of the latest experimental reports. Cross sections for superheavy nuclei are evaluated using "Fusion by Diffusion" (FBD) model. Predictive…

This chapter starts with a summary of the atomistic processes that occur during epitaxy. We then introduce density functional theory (DFT) and describe its implementation into state-of-the-art computations of complex processes in condensed…

Condensed Matter · Physics 2009-09-25 P. Ruggerone , C. Ratsch , M. Scheffler

Reliable calculations of the structure of heavy elements are crucial to address fundamental science questions such as the origin of the elements in the universe. Applications relevant for energy production, medicine, or national security…

Time-dependent density-functional theory (TDDFT) is deemed to be a formally rigorous way of dealing with the time-evolution of a many-electron system at the level of electron densities rather than the underlying wavefunctions, which in turn…

Chemical Physics · Physics 2024-11-26 Jochen Schirmer

This article summarizes recent progress in our understanding of the reaction mechanisms leading to the formation of superheavy nuclei in cold and hot fusion reactions. Calculations are done within the Fusion-by-Diffusion (FBD) model using…

Nuclear Theory · Physics 2022-12-14 T. Cap , M. Kowal , K. Siwek-Wilczyńska
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