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Selective sensing of chiral molecules is a key aspect in fields spanning biology, chemistry, and pharmacology. However, conventional optical methods, such as circular dichroism (CD), encounter limitations owing to weak chiral light-matter…

The blue phases are fascinating and complex states of chiral liquid crystals which can be modeled by a comprehensive framework of the Landau-de theory, satisfying energy dissipation and maximum bound principle. In this paper, we develop and…

Numerical Analysis · Mathematics 2025-11-04 Wenshuai Hu , Guanghua Ji

We developed single-shot shaped pulses for ultra high fidelity (UH-fidelity) population transfer on a 3-level quantum system in lambda configuration. To ensure high fidelity, we use the Lewis-Riesenfeld (L-R) method to derive a family of…

Quantum Physics · Physics 2019-09-27 Xavier Laforgue , Stéphane Guérin , Xi Chen

The classical method of determining the atomic structure of complex molecules by analyzing diffraction patterns is currently undergoing drastic developments. Modern techniques for producing extremely bright and coherent X-ray lasers allow a…

Biomolecules · Quantitative Biology 2015-10-12 Tomas Ekeberg , Stefan Engblom , Jing Liu

In this paper we introduce five different algorithms based on method of moments, maximum likelihood and full Bayesian estimation for learning the parameters of the Inverse Gamma distribution. We also provide an expression for the KL…

Methodology · Statistics 2016-07-11 A. Llera , C. F. Beckmann

Computational cost of energy estimation for molecular electronic Hamiltonians via Quantum Phase Estimation (QPE) grows with the difference between the largest and smallest eigenvalues of the Hamiltonian. In this work we propose a…

Quantum Physics · Physics 2023-10-26 Ignacio Loaiza , Artur F. Izmaylov

Accurately treating electron correlation in the wavefunction is a key challenge for both classical and quantum computational chemistry. Classical methods have been developed which explicitly account for this correlation by incorporating…

Quantum Physics · Physics 2020-06-22 Sam McArdle , David P. Tew

We introduce and implement an interferometric technique based on chirped femtosecond laser pulses and nonlinear optics. The interference manifests as a high-visibility (> 85%) phase-insensitive dip in the intensity of an optical beam when…

Quantum Physics · Physics 2008-11-07 R. Kaltenbaek , J. Lavoie , D. N. Biggerstaff , K. J. Resch

The practical applications of chiral discrimination are usually limited by the weak chiral response of enantiomers and the high complexity of detection methods. Here, we propose to use the C lines (i.e., lines of polarization singularities)…

Optics · Physics 2022-03-22 Shiqi Jia , Jie Peng , Yuqiong Cheng , Shubo Wang

Automatic differentiation is a tool for numerically calculating derivatives of a given function up to machine precision. This tool is useful for quantum chemistry methods, which require the calculation of gradients either for the…

Chemical Physics · Physics 2020-11-25 Fabijan Pavošević , Sharon Hammes-Schiffer

In this paper we present a hybrid approach to numerically solve two-dimensional electromagnetic inverse scattering problems, whereby the unknown scatterer is hosted by a possibly inhomogeneous background. The approach is `hybrid' in that it…

Analysis of PDEs · Mathematics 2012-10-22 G. Giorgi , M. Brignone , R. Aramini , M. Piana

A phase transition can drive the spontaneous emergence of chiral orders in crystals below a critical temperature. However, selecting either a right- or a left-handed phase with the aid of electromagnetic fields is challenging, particularly…

Materials Science · Physics 2025-03-11 Mauro Fava , Aldo H. Romero , Eric Bousquet

We present a novel approach to chiral discrimination using gate-based quantum processors, addressing a key challenge in adapting conventional control techniques using modern quantum computing. Schemes such as stimulated rapid adiabatic…

Quantum Physics · Physics 2026-01-07 Muhammad Arsalan Ali Akbar , Sabre Kais

We design, by invariant-based inverse engineering, driving fields that invert the population of a two-level atom in a given time, robustly with respect to dephasing noise and/or systematic frequency shifts. Without imposing constraints,…

Quantum Physics · Physics 2013-09-10 Xiao-Jing Lu , Xi Chen , A. Ruschhaupt , D. Alonso , S. Guérin , J. G. Muga

Controlling the internal quantum states of chiral molecules for a selected enantiomer has a wide range of fundamental applications. Using tailored microwave fields, a chosen rotational state can be enriched for a selected enantiomer, even…

Chemical Physics · Physics 2024-02-28 JuHyeon Lee , Elahe Abdiha , Boris G. Sartakov , Gerard Meijer , Sandra Eibenberger-Arias

Diffraction tomography is a noninvasive technique that estimates the refractive indices of unknown objects and involves an inverse-scattering problem governed by the wave equation. Recent works have shown the benefit of nonlinear models of…

Image and Video Processing · Electrical Eng. & Systems 2021-07-09 Tao Hong , Thanh-an Pham , Eran Treister , Michael Unser

In this work, we exploit the idea of composite pulses to achieve robust population inversion in a three-level quantum system. The scheme is based on the modulation of the coupling strength, while the other physical parameters remain…

Quantum Physics · Physics 2022-04-11 Cheng Zhang , Yang Liu , Zhi-Cheng Shi , Jie Song , Yan Xia , Shi-Biao Zheng

In order to identify clusters of objects with features transformed by unknown affine transformations, we develop a Bayesian cluster process which is invariant with respect to certain linear transformations of the feature space and able to…

Methodology · Statistics 2016-12-01 Hsin-Hsiung Huang , Jie Yang

Indirect imaging problems in biomedical optics generally require repeated evaluation of forward models of radiative transport, for which Monte Carlo is accurate yet computationally costly. We develop a novel approach to reduce this…

Computational Physics · Physics 2020-07-10 Callum M. Macdonald , Simon Arridge , Samuel Powell

Chiral molecules interact and react differently with other chiral objects, depending on their handedness. Therefore, it is essential to understand and ultimately control the evolution of molecular chirality during chemical reactions.…

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