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In ab initio pseudopotential calculations within density-functional theory the nonlinear exchange-correlation interaction between valence and core electrons is often treated linearly through the pseudopotential. We discuss the accuracy and…

Materials Science · Physics 2009-10-30 Martin Fuchs , Michel Bockstedte , Eckhard Pehlke , Matthias Scheffler

Proposed silicon-based quantum-computer architectures have attracted attention because of their promise for scalability and their potential for synergetically utilizing the available resources associated with the existing Si technology…

Materials Science · Physics 2009-11-10 Belita Koiller , R. B. Capaz , X. Hu , S. Das Sarma

We study the collective effects that emerge in waveguide quantum electrodynamics where several (artificial) atoms are coupled to a one-dimensional superconducting transmission line. Since single microwave photons can travel without loss for…

Exchange interaction has been studied for electrons in coupled quantum dots (QD's) by a configuration interaction method using confinement potentials with different profiles. The confinement potential has been parametrized by a two-centre…

Mesoscale and Nanoscale Physics · Physics 2015-05-13 A. Kwasniowski , J. Adamowski

We investigate the on-shell approximation in the context of s-wave scattering for ultracold two-body collisions. Our analysis systematically covers spatial dimensions D=1,2,3 , with the aim of identifying the regimes in which the…

Quantum Gases · Physics 2025-11-21 Francesco Lorenzi , Luca Salasnich

Efficient transduction of electromagnetic signals between different frequency scales is an essential ingredient for modern communication technologies as well as for the emergent field of quantum information processing. Recent advances in…

Quantum Physics · Physics 2019-11-27 Vincent E. Elfving , Sumanta Das , Anders S. Sørensen

We develop an Over Barrier Model for computing charge exchange between ions and one-active-electron atoms at low impact energies. The main feature of the model is the treatment of the barrier crossing process by the electron within a…

Atomic Physics · Physics 2007-05-23 F. Sattin

We investigate the exchange effect between the final atom's bound electrons and those emitted in the allowed $\beta$-decay of the initial nucleus. The electron wave functions are obtained with the Dirac-Hartree-Fock-Slater self-consistent…

Atomic Physics · Physics 2024-07-17 O. Niţescu , S. Stoica , F. Šimkovic

The accuracy of applying density functional theory to noncovalent interactions is hindered by errors arising from low-density regions of interaction-induced change in the density gradient, error compensation between correlation and exchange…

Chemical Physics · Physics 2014-10-22 Marcin Modrzejewski , Grzegorz Chałasiński , Małgorzata M. Szczęśniak

The role played by the effective residual interaction in the transverse nuclear response for quasi-free electron scattering is discussed. The analysis is done by comparing different calculations performed in the Random--Phase Approximation…

Nuclear Theory · Physics 2008-11-26 Eduardo Bauer , Antonio M. Lallena

We calculate the exchange coupling J between electrons in a double-well potential in a two-dimensional semiconductor environment within the Heitler-London (HL) approach. Two functional forms are considered for the double-well potential. We…

Other Condensed Matter · Physics 2008-01-16 A. L. Saraiva , M. J. Calderon , Belita Koiller

Quantal diffusion mechanism of nucleon exchange is studied in the central collisions of several symmetric heavy-ion collisions in the framework of the Stochastic Mean-Field (SMF) approach. Since at bombarding energies below the fusion…

Nuclear Theory · Physics 2016-11-23 S. Ayik , O. Yilmaz , B. Yilmaz , A. S. Umar

We present a systematic and realistic simulation for single and double phosphorous donors in a silicon-based quantum computer design. A two-valley equation is developed to describe the ground state of phosphorous donors in strained silicon…

Mesoscale and Nanoscale Physics · Physics 2009-11-11 Angbo Fang , Yia-Chung Chang , J. R. Tucker

Quasi-two-dimensional (2D) systems, such as an electron gas confined in a quantum well, are important model systems for many-body theories. Earlier studies of the crossover from 3D to 2D in ground-state density-functional theory showed that…

Mesoscale and Nanoscale Physics · Physics 2015-06-23 Shahrzad Karimi , Carsten A. Ullrich

We present an approach for computing long-range van der Waals (vdW) interactions between complex molecular systems and arbitrarily shaped macroscopic bodies, melding atomistic treatments of electronic fluctuations based on density…

Mesoscale and Nanoscale Physics · Physics 2017-07-05 Prashanth S. Venkataram , Jan Hermann , Alexandre Tkatchenko , Alejandro W. Rodriguez

Multi-donor architecture in silicon offers a promising direction towards scalable solid-state qubits and quantum technologies operating at practical conditions. However, the overlap of multiple donor wave-functions develops a complex…

Mesoscale and Nanoscale Physics · Physics 2025-12-17 Soumya Chakraborty , Pooja Sudha , Hemant Arora , Daniel Moraru , Arup Samanta

We calculate the electronic wave-function for a phosphorus donor in silicon by numerical diagonalisation of the donor Hamiltonian in the basis of the pure crystal Bloch functions. The Hamiltonian is calculated at discrete points localised…

Materials Science · Physics 2009-11-11 C. J. Wellard , L. C. L. Hollenberg

We consider a general problem of inelastic collision of particles interacting with power-law potentials. Using quantum defect theory we derive an analytical formula for the energy-dependent complex scattering length, valid for arbitrary…

Atomic Physics · Physics 2014-10-14 Krzysztof Jachymski , Michał Krych , Paul S. Julienne , Zbigniew Idziaszek

We present a practical and accurate density functional for the exchange-correlation energy of electrons in two dimensions. The exchange part is based on a recent two-dimensional generalized-gradient approximation derived by considering the…

Strongly Correlated Electrons · Physics 2010-06-30 E. Rasanen , S. Pittalis , J. G. Vilhena , M. A. L. Marques

We analyze data on deep inelastic scattering of electrons from the proton using ideas from standard many-body theory involving {\em bound} constituents subject to {\em interactions}. This leads us to expect, at large three-momentum transfer…

Nuclear Theory · Physics 2009-11-06 O. Benhar , V. R. Pandharipande , I. Sick
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