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https://www.readbyqxmd.com/read/29356250/application-of-the-interacting-quantum-atoms-approach-to-the-s66-and-ionic-hb-datasets-for-noncovalent-interactions
#1
Dimas Suarez, Natalia Díaz, Angel Martín Pendás, Evelio Francisco
The interacting quantum atoms (IQA) method can assess, systematically and in great detail, the strength and physics of both covalent and noncovalent interactions. The lack of a pair density in density functional theory (DFT), which precludes the direct IQA decomposition of the characteristic exchange-correlation energy, has been recently overcome by means of a scaling technique, what can largely expand the applicability of the method. To better assess the utility of the augmented IQA methodology in order to derive quantum chemical decompositions at the atomic and molecular levels, we report the results of HF and DFT calculations on the complexes included in the S66 and the ionic H-bond databases of benchmark geometry and binding energies...
January 22, 2018: Chemphyschem: a European Journal of Chemical Physics and Physical Chemistry
https://www.readbyqxmd.com/read/29355831/coherent-control-of-single-electrons-a-review-of-current-progress
#2
Christopher Bauerle, Christian Glattli, Tristan Meunier, Fabien Portier, Patrice Roche, Preden Roulleau, Shintaro Takada, Xavier Waintal
In this report we review the present state of the art of the control of propagating quantum states at the single electron level and its potential application to quantum information processing. We give an overview of the different approaches which have been developed over the last years in order to gain full control over a propagating single electron in a solid state system. After a brief introduction of the basic concepts, we present experiments on ying qubit circuits for ensemble of electrons measured in the low frequency (DC) limit...
January 22, 2018: Reports on Progress in Physics
https://www.readbyqxmd.com/read/29354964/-discussion-on-quantum-entanglement-theory-and-acupuncture
#3
Jun Wang, Bin Wu, Sheng Chen
The quantum entanglement is a new discovery of modern physics and has drawn a widely attention in the world. After learning the quantum entanglement, the authors have found that many characteristics of quantum are reflected in TCM, acupuncture theory and clinical practice. For example, the quantum entanglement phenomenon is mutually verified with the holism, yinyang doctrine, the theory of primary, secondary, root and knot in TCM, etc. It can be applied to interpret the clinical situations which is difficult to be explained in clinical practice, such as the instant effect of acupuncture, multi-point stimulation in one disorder and the points with specific effects...
November 12, 2017: Zhongguo Zhen Jiu, Chinese Acupuncture & Moxibustion
https://www.readbyqxmd.com/read/29353815/the-challenge-of-spin-orbit-tuned-ground-states-in-iridates-a-key-issues-review
#4
Gang Cao, Pedro Schlottmann
Effects of spin-orbit interactions in condensed matter are an important and rapidly evolving topic. Strong competition between spin-orbit, on-site Coulomb and crystalline electric field interactions in iridates drives exotic quantum states that are unique to this group of materials. In particular, the "Jeff = ½" Mott state served as an early signal that the combined effect of strong spin-orbit and Coulomb interactions in iridates has unique, intriguing consequences. In this Key Issues Review, we survey some current experimental studies of iridates...
January 22, 2018: Reports on Progress in Physics
https://www.readbyqxmd.com/read/29353814/a-review-of-the-quantum-hall-effects-in-mgzno-zno-heterostructures
#5
Joseph Falson, Masashi Kawasaki
This review visits recent experimental efforts on high mobility two-dimensional electron systems (2DES) hosted at the Mg<sub><i>x</i></sub>Zn<sub>1-<i>x</i></sub>O/ZnO heterointerface. We begin with the growth of these samples, and highlight the key characteristics of ozone-assisted molecular beam epitaxy required for their production. The transport characteristics of these structures are found to rival that of traditional semiconductor material systems, as signified by the high electron mobility (<i>μ</i> > 1,000,000 cm<sup>2</sup>/Vs) and rich quantum Hall features...
January 22, 2018: Reports on Progress in Physics
https://www.readbyqxmd.com/read/29353812/a-tale-of-two-metals-contrasting-criticalities-in-the-pnictides-and-hole-doped-cuprates
#6
Nigel E Hussey, Jonathan Buhot, Salvatore Licciardello
The iron-based high temperature superconductors share a number of similarities with their copper-based counterparts, such as reduced dimensionality, proximity to states of competing order, and a critical role for 3d electron orbitals. Their respective temperature-doping phase diagrams also contain certain commonalities that have led to claims that the metallic and superconducting properties of both families are governed by their proximity to a quantum critical point (QCP) located inside the superconducting dome...
January 22, 2018: Reports on Progress in Physics
https://www.readbyqxmd.com/read/29352773/ultra-fast-relaxation-decoherence-and-localization-of-photoexcited-states-in-%C3%AF-conjugated-polymers
#7
Jonathan R Mannouch, William Barford, Sarah Al-Assam
The exciton relaxation dynamics of photoexcited electronic states in poly(p-phenylenevinylene) are theoretically investigated within a coarse-grained model, in which both the exciton and nuclear degrees of freedom are treated quantum mechanically. The Frenkel-Holstein Hamiltonian is used to describe the strong exciton-phonon coupling present in the system, while external damping of the internal nuclear degrees of freedom is accounted for by a Lindblad master equation. Numerically, the dynamics are computed using the time evolving block decimation and quantum jump trajectory techniques...
January 21, 2018: Journal of Chemical Physics
https://www.readbyqxmd.com/read/29350962/high-speed-device-independent-quantum-random-number-generation-without-a-detection-loophole
#8
Yang Liu, Xiao Yuan, Ming-Han Li, Weijun Zhang, Qi Zhao, Jiaqiang Zhong, Yuan Cao, Yu-Huai Li, Luo-Kan Chen, Hao Li, Tianyi Peng, Yu-Ao Chen, Cheng-Zhi Peng, Sheng-Cai Shi, Zhen Wang, Lixing You, Xiongfeng Ma, Jingyun Fan, Qiang Zhang, Jian-Wei Pan
Quantum mechanics provides the means of generating genuine randomness that is impossible with deterministic classical processes. Remarkably, the unpredictability of randomness can be certified in a manner that is independent of implementation devices. Here, we present an experimental study of device-independent quantum random number generation based on a detection-loophole-free Bell test with entangled photons. In the randomness analysis, without the independent identical distribution assumption, we consider the worst case scenario that the adversary launches the most powerful attacks against the quantum adversary...
January 5, 2018: Physical Review Letters
https://www.readbyqxmd.com/read/29350954/invariance-of-topological-indices-under-hilbert-space-truncation
#9
Zhoushen Huang, W Zhu, Daniel P Arovas, Jian-Xin Zhu, Alexander V Balatsky
We show that the topological index of a wave function, computed in the space of twisted boundary phases, is preserved under Hilbert space truncation, provided the truncated state remains normalizable. If truncation affects the boundary condition of the resulting state, the invariant index may acquire a different physical interpretation. If the index is symmetry protected, the truncation should preserve the protecting symmetry. We discuss implications of this invariance using paradigmatic integer and fractional Chern insulators, Z_{2} topological insulators, and spin-1 Affleck-Kennedy-Lieb-Tasaki and Heisenberg chains, as well as its relation with the notion of bulk entanglement...
January 5, 2018: Physical Review Letters
https://www.readbyqxmd.com/read/29348413/synthesis-of-luminescent-carbon-dots-with-ultrahigh-quantum-yield-and-inherent-folate-receptor-positive-cancer-cell-targetability
#10
Haifang Liu, Zhaohui Li, Yuanqiang Sun, Xin Geng, Yalei Hu, Hongmin Meng, Jia Ge, Lingbo Qu
Carbon dots (CDs) have a wide range of applications in chemical, physical and biomedical research fields. We are particularly interested in the use of CDs as fluorescence nanomaterials for targeted tumor cell imaging. One of the important aspects of success is to enhance the fluorescence quantum yields (QY) of CDs as well as increase their targetability to tumor cells. However, most of the reported CDs are limited by relative low QY. In the current study, for the first time, one-step synthesis of highly luminescent CDs by using folic acid (FA) as single precursor was obtained in natural water through hydrothermal method...
January 18, 2018: Scientific Reports
https://www.readbyqxmd.com/read/29348200/active-learning-machine-learns-to-create-new-quantum-experiments
#11
Alexey A Melnikov, Hendrik Poulsen Nautrup, Mario Krenn, Vedran Dunjko, Markus Tiersch, Anton Zeilinger, Hans J Briegel
How useful can machine learning be in a quantum laboratory? Here we raise the question of the potential of intelligent machines in the context of scientific research. A major motivation for the present work is the unknown reachability of various entanglement classes in quantum experiments. We investigate this question by using the projective simulation model, a physics-oriented approach to artificial intelligence. In our approach, the projective simulation system is challenged to design complex photonic quantum experiments that produce high-dimensional entangled multiphoton states, which are of high interest in modern quantum experiments...
January 18, 2018: Proceedings of the National Academy of Sciences of the United States of America
https://www.readbyqxmd.com/read/29347792/resonances-in-a-periodically-driven-bosonic-system
#12
Anton Quelle, Cristiane Morais Smith
Periodically driven systems are a common topic in modern physics. In optical lattices specifically, driving is at the origin of many interesting phenomena. However, energy is not conserved in driven systems, and under periodic driving, heating of a system is a real concern. In an effort to better understand this phenomenon, the heating of single-band systems has been studied, with a focus on disorder- and interaction-induced effects, such as many-body localization. Nevertheless, driven systems occur in a much wider context than this, leaving room for further research...
November 2017: Physical Review. E
https://www.readbyqxmd.com/read/29347760/anomalies-in-the-equilibrium-and-nonequilibrium-properties-of-correlated-ions-in-complex-molecular-environments
#13
Sathiya Mahakrishnan, Subrata Chakraborty, Amrendra Vijay
Emergent statistical attributes, and therefore the equations of state, of an assembly of interacting charge carriers embedded within a complex molecular environment frequently exhibit a variety of anomalies, particularly in the high-density (equivalently, the concentration) regime, which are not well understood, because they do not fall under the low-concentration phenomenologies of Debye-Hückel-Onsager and Poisson-Nernst-Planck, including their variants. To go beyond, we here use physical concepts and mathematical tools from quantum scattering theory, transport theory with the Stosszahlansatz of Boltzmann, and classical electrodynamics (Lorentz gauge) and obtain analytical expressions both for the average and the frequency-wave vector-dependent longitudinal and transverse current densities, diffusion coefficient, and the charge density, and therefore the analytical expressions for (a) the chemical potential, activity coefficient, and the equivalent conductivity for strong electrolytes and (b) the current-voltage characteristics for ion-transport processes in complex molecular environments...
November 2017: Physical Review. E
https://www.readbyqxmd.com/read/29347697/multichannel-scattering-problem-with-a-nonseparable-angular-part-as-a-boundary-value-problem
#14
Shahpoor Saeidian, Vladimir S Melezhik
We have developed an efficient computational method for solving the quantum multichannel scattering problem with a nonseparable angular part. The use of the nondirect product discrete-variable representation, suggested and developed by V. Melezhik, gives us an accurate approximation for the angular part of the desired wave function and, eventually, for the scattering parameters. Subsequent reduction of the problem to the boundary-value problem with well-defined block-band matrix of equation coefficients permits us to use efficient standard algorithms for its solution...
November 2017: Physical Review. E
https://www.readbyqxmd.com/read/29347588/finite-size-effects-in-canonical-and-grand-canonical-quantum-monte-carlo-simulations-for-fermions
#15
Zhenjiu Wang, Fakher F Assaad, Francesco Parisen Toldin
We introduce a quantum Monte Carlo method at finite temperature for interacting fermionic models in the canonical ensemble, where the conservation of the particle number is enforced. Although general thermodynamic arguments ensure the equivalence of the canonical and the grand-canonical ensembles in the thermodynamic limit, their approach to the infinite-volume limit is distinctively different. Observables computed in the canonical ensemble generically display a finite-size correction proportional to the inverse volume, whereas in the grand-canonical ensemble the approach is exponential in the ratio of the linear size over the correlation length...
October 2017: Physical Review. E
https://www.readbyqxmd.com/read/29347335/saturation-of-entropy-production-in-quantum-many-body-systems
#16
Kazuya Kaneko, Eiki Iyoda, Takahiro Sagawa
Bridging the second law of thermodynamics and microscopic reversible dynamics has been a longstanding problem in statistical physics. Here, we address this problem on the basis of quantum many-body physics, and discuss how the entropy production saturates in isolated quantum systems under unitary dynamics. First, we rigorously prove that the entropy production does indeed saturate in the long time regime, even when the total system is in a pure state. Second, we discuss the non-negativity of the entropy production at saturation, implying the second law of thermodynamics...
December 2017: Physical Review. E
https://www.readbyqxmd.com/read/29347183/quantum-dynamics-of-long-range-interacting-systems-using-the-positive-p-and-gauge-p-representations
#17
S Wüster, J F Corney, J M Rost, P Deuar
We provide the necessary framework for carrying out stochastic positive-P and gauge-P simulations of bosonic systems with long-range interactions. In these approaches, the quantum evolution is sampled by trajectories in phase space, allowing calculation of correlations without truncation of the Hilbert space or other approximations to the quantum state. The main drawback is that the simulation time is limited by noise arising from interactions. We show that the long-range character of these interactions does not further increase the limitations of these methods, in contrast to the situation for alternatives such as the density matrix renormalization group...
July 2017: Physical Review. E
https://www.readbyqxmd.com/read/29347171/properties-and-relative-measure-for-quantifying-quantum-synchronization
#18
Wenlin Li, Wenzhao Zhang, Chong Li, Heshan Song
Although quantum synchronization phenomena and corresponding measures have been widely discussed recently, it is still an open question how to characterize directly the influence of nonlocal correlation, which is the key distinction for identifying classical and quantum synchronizations. In this paper, we present basic postulates for quantifying quantum synchronization based on the related theory in Mari's work [Phys. Rev. Lett. 111, 103605 (2013)PRLTAO0031-900710.1103/PhysRevLett.111.103605], and we give a general formula of a quantum synchronization measure with clear physical interpretations...
July 2017: Physical Review. E
https://www.readbyqxmd.com/read/29347155/laser-opacity-in-underdense-preplasma-of-solid-targets-due-to-quantum-electrodynamics-effects
#19
W-M Wang, P Gibbon, Z-M Sheng, Y-T Li, J Zhang
We investigate how next-generation laser pulses at 10-200PW interact with a solid target in the presence of a relativistically underdense preplasma produced by amplified spontaneous emission (ASE). Laser hole boring and relativistic transparency are strongly restrained due to the generation of electron-positron pairs and γ-ray photons via quantum electrodynamics (QED) processes. A pair plasma with a density above the initial preplasma density is formed, counteracting the electron-free channel produced by hole boring...
July 2017: Physical Review. E
https://www.readbyqxmd.com/read/29346953/quantum-statistical-effects-in-the-mass-transport-of-interstitial-solutes-in-a-crystalline-solid
#20
C H Woo, Haohua Wen
The impact of quantum statistics on the many-body dynamics of a crystalline solid at finite temperatures containing an interstitial solute atom (ISA) is investigated. The Mori-Zwanzig theory allows the many-body dynamics of the crystal to be formulated and solved analytically within a pseudo-one-particle approach using the Langevin equation with a quantum fluctuation-dissipation relation (FDR) based on the Debye model. At the same time, the many-body dynamics is also directly solved numerically via the molecular dynamics approach with a Langevin heat bath based on the quantum FDR...
September 2017: Physical Review. E
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