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An analytic approach to the electron transport phenomena in molecular devices is presented. Analyzed devices are composed of organic molecules attached to the two semi-infinite electrodes. Molecular system is described within the…

Mesoscale and Nanoscale Physics · Physics 2007-05-23 Kamil Walczak

We investigate two key representative semiclassical approaches for propagating resonant energy transfer between a pair of electronic two-level systems (donor and acceptor) with coupled Maxwell-Liouville equations. On the one hand, when the…

Chemical Physics · Physics 2018-10-03 Tao E. Li , Hsing-Ta Chen , Abraham Nitzan , Maxim Sukharev , Joseph E. Subotnik

We study a quantum computer with fixed and permanent interaction of diagonal type between qubits. It is controlled only by one-qubit quick transformations. It is shown how to implement Quantum Fourier Transform and to solve Shroedinger…

Quantum Physics · Physics 2007-05-23 Yuri Ozhigov

Tunneling of electrons through the barriers in heterostructures has been studied, within unified transfer matrix approach. The effect of barrier width on the transmission coefficient of the electrons has been investigated for different…

Mesoscale and Nanoscale Physics · Physics 2010-02-10 Jatindranath Gain , Madhumita Das Sarkar , Sudakshina Kundu

Coherent interconnects between gate-defined silicon quantum processing units are essential for scalable quantum computation and long-range entanglement. We argue that one-dimensional electron channels formed in the silicon quantum well of a…

Mesoscale and Nanoscale Physics · Physics 2026-01-12 Anantha S. Rao , Christopher David White , Sean R. Muleady , Anthony Sigillito , Michael J. Gullans

The exact exchange potential in time-dependent density-functional theory is defined as an orbital functional through the time-dependent optimized effective potential (TDOEP) method. We numerically solve the TDOEP integral equation for the…

Mesoscale and Nanoscale Physics · Physics 2009-11-13 H. O. Wijewardane , C. A. Ullrich

Interactions between quantum particles, such as electrons, are the source of important effects, ranging from superconductivity, to the formation of molecular bonds, or the stability of elementary compounds at high-energies. In this article,…

Quantum Physics · Physics 2025-06-16 Javier Argüello-Luengo

We describe an electrodynamic mechanism for coherent, quantum mechanical coupling between spacially separated quantum dots on a microchip. The technique is based on capacitive interactions between the electron charge and a superconducting…

Quantum Physics · Physics 2009-11-10 L. I. Childress , A. S. Sorensen , M. D. Lukin

We apply the frozen density embedding method, using a full relaxation of embedded densities through a freeze-and-thaw procedure, to study the electronic structure of several benchmark ground-state charge-transfer complexes, in order to…

Chemical Physics · Physics 2013-04-17 S. Laricchia , E. Fabiano , F. Della Sala

A semiclassical distorted wave (SCDW) model with Wigner transform of one-body density matrix is presented for multistep direct $(p,p^{\prime}x)$ reactions to the continuum. The model uses Wigner distribution functions obtained in methods…

Nuclear Theory · Physics 2007-05-23 M. K. Gaidarov , Y. Watanabe , K. Ogata , M. Kohno , M. Kawai , A. N. Antonov

The quasiparticle bands of diamond, a prototype covalent insulator, are herein studied by means of wave-function electronic-structure theory, with emphasis on the nature of the correlation hole around a bare particle. Short-range…

The quantum world distinguishes itself from the classical world by being governed by probability amplitudes rather than probabilities. On a single-particle level, quantum phases can be manipulated leading to observable interference patterns…

Quantum Physics · Physics 2021-08-11 Nahid Talebi , Iva Březinová

Entangling two quantum bits by letting them interact is the crucial requirements for building a quantum processor. For qubits based on the spin of the electron, these two-qubit gates are typically performed by exchange interaction of the…

Mesoscale and Nanoscale Physics · Physics 2015-12-07 Fabian Hassler , Gianluigi Catelani , Hendrik Bluhm

We have employed x-ray spectroscopy to probe the charge changing process only in the bulk of the foil when swift heavy ions pass through it. In contrast, the electromagnetic methods take into account integral effect of the charge changing…

Atomic Physics · Physics 2019-05-14 Tapan Nandi , Prashant Sharma , Pravin Kumar

Donor states in Si nanodevices can be strongly modified by nearby insulating barriers and metallic gates. We report here experimental results indicating a strong reduction in the charging energy of isolated As dopants in Si FinFETs relative…

Mesoscale and Nanoscale Physics · Physics 2010-08-31 M. J. Calderon , J. Verduijn , G. P. Lansbergen , G. C. Tettamanzi , S. Rogge , Belita Koiller

Long-range exchange and correlation effects, responsible for the failure of currently used approximate density functionals in describing van der Waals forces, are taken into account explicitly after a separation of the electron-electron…

Materials Science · Physics 2009-11-11 Janos G. Angyan , Iann C. Gerber , Andreas Savin , Julien Toulouse

The nuclear tunneling crossover temperature ($T_c$) of hydrogen transfer reactions in supported molecular-switch architectures can lie close to room temperature. This calls for the inclusion of nuclear quantum effects (NQE) in the…

Chemical Physics · Physics 2020-11-25 Yair Litman , Mariana Rossi

Diluted magnetic semiconductors (DMS) like Ga$_{1-x}$Mn$_{x}$As are described by a realistic tight-binding model (TBM) for the (valence) bands of GaAs, by a Zener (J-)term modeling the coupling of the localized Mn-spins to the spins of the…

Strongly Correlated Electrons · Physics 2014-04-09 Stefan Barthel , Gerd Czycholl , Georges Bouzerar

We predict a gigantically long lifetime of the first excited state of an interstitial lithium donor in silicon. The nature of this effect roots in the anomalous level structure of the {\em 1s} Li manifold under external stress. Namely, the…

Quantum Physics · Physics 2009-11-10 V. N. Smelyanskiy , A. G. Petukhov , V. V. Osipov

We determine the conditions under which the presence of long-range interactions reduce the energy losses due to defect generation during non-adiabatic evolution, crucial for enhancing the power to efficiency ratio of quantum thermal…

Statistical Mechanics · Physics 2025-04-07 Andrea Solfanelli , Nicolò Defenu