Efficient two-electron ansatz for benchmarking quantum chemistry on a quantum computer
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In view of the continuous theoretical efforts aimed at an accurate microscopic description of the strongly correlated transition metal oxides and related materials, we show that with continuum quantum Monte Carlo (QMC) calculations it is possible to obtain the value of the spin superexchange coupling constant of a copper oxide in a quantitatively excellent agreement with experiment. The variational nature of the QMC total energy allows us to identify the best trial wave function out of the available pool of wave functions, which makes the approach essentially free from adjustable parameters and thus truly ab initio. The present results on magnetic interactions suggest that QMC is capable of accurately describing ground state properties of strongly correlated materials.
We introduce , a protocol that streamlines traditional RB by using circuits consisting almost entirely of independent identically distributed (IID) layers of gates. BiRB reliably and efficiently extracts the average error rate of a Clifford gate set by sending tensor-product eigenstates of random Pauli operators through random circuits with IID layers. Unlike existing RB methods, BiRB does not use motion reversal circuits—i.e., circuits that implement the identity (or a Pauli) operator—which simplifies both the method and the theory proving its reliability. Furthermore, this simplicity enables scaling BiRB to many more qubits than the most widely used RB methods. Published by the American Physical Society 2024
Global analysis of collider and fixed-target experimental data and calculations from lattice quantum chromodynamics (QCD) are used to gain complementary information on the structure of hadrons. We propose novel “window observables” that allow for higher precision cross-validation between the different approaches, a critical step for studies that wish to combine the datasets. Global analyses are limited by the kinematic regions accessible to experiment, particularly in a range of Bjorken-𝑥, and lattice QCD calculations also have limitations requiring extrapolations to obtain the parton distributions. We provide two different window observables that can be defined within a region of 𝑥 where extrapolations and interpolations in global analyses remain reliable and where lattice QCD results retain sensitivity and precision.
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Quality datasets serve a critical purpose in cyber security research. Data is needed to understand system behavior and develop security controls to protect critical systems. However, for critical infrastructure operational environments there is a lack of available datasets to study because of the high cost and specialized capabilities necessary to generate them. This paper documents the development of a dataset of high fidelity hardware in the loop laboratory simulated models of electric and natural gas distribution systems with real cyber attack test cases. A deep dive discussion for the experimental setup and controls for generating the data is provided along with observations from using the data in evaluating intrusion detection approaches.
This research focuses on user-centric approach of building such tools and proposes a flexible, extensible, and easy to use framework to support performance analysis of Big Data systems. Finally, case studies from two different domains are presented to validate the framework.
As the photovoltaic (PV) industry is rapidly expanding around the world, there has been an increasing interest in extending the lifespan of PV modules. Concern has also emerged regarding the recyclability of modules and their component materials, including fluoropolymer-based backsheets. Laminated polyethylene-terephthalate (PET) core backsheets have traditionally been used in the PV industry, but new, coextruded polyolefin (PO) backsheets show promise as an improved alternative. In this work, minimodule and coupon samples of seven different backsheets (made of layers including contemporary PET and fluoropolymers, novel PO, and polyamide materials) were run through hygrometric- or UV photolytic-accelerated aging to identify and better understand each material's degradation modes and the backsheets' field reliability. In addition to the artificial aging, the natural weathering methods used in this article are described. The comprehensive set of chemical, mechanical, and structural characterizations at intermittent read points in this article is presented, including: visual appearance and color; gloss; mechanical tensile testing; I-V performance; electroluminescence (EL) imaging; dielectric breakdown; Fourier-transform infrared-chemical structure; X-ray-polymer structure; and differential scanning calorimetry-crystalline content. After 4000 h of aging, a strong correlation occurs between initial physical characteristics (mechanical tensile test) and operating performance (EL and I-V characteristics).
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