A note on many valued quantum computational logics
Sign Up to like & getrecommendations! Published in 2017 at "Soft Computing"
DOI: 10.1007/s00500-015-1790-6
Abstract: The standard theory of quantum computation relies on the idea that the basic information quantity is represented by a superposition of elements of the canonical basis and the notion of probability naturally follows from the… read more here.
Keywords: valued quantum; many valued; computational logics; note many ... See more keywords
A Quantum Computational Method for Corrosion Inhibition
Sign Up to like & getrecommendations! Published in 2025 at "Journal of Chemical Theory and Computation"
DOI: 10.1021/acs.jctc.5c00469
Abstract: We present a hybrid classical-quantum computational pipeline for the determination of adsorption energies of a benzotriazole molecule on an aluminum alloy surface relevant for the transport industry, in particular to address the corrosion problem. The… read more here.
Keywords: corrosion inhibition; quantum computational; computational method; method corrosion ... See more keywords
Role of Coherence for Quantum Computational Advantage.
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DOI: 10.1103/1csn-x1cx
Abstract: Quantifying the resources available to a quantum computer appears to be necessary to separate quantum from classical computation. Among them, entanglement, nonstabilizerness, and coherence are arguably of great significance. We introduce "path coherence" as a… read more here.
Keywords: role coherence; computational advantage; quantum computational; coherence ... See more keywords
Quantum Computational Investigation of (E)-1-(4-methoxyphenyl)-5-methyl-N′-(3-phenoxybenzylidene)-1H-1,2,3-triazole-4-carbohydrazide
Sign Up to like & getrecommendations! Published in 2022 at "Molecules"
DOI: 10.3390/molecules27072193
Abstract: The title compound was synthesized and structurally characterized. Theoretical IR, NMR (with the GIAO technique), UV, and nonlinear optical properties (NLO) in four different solvents were calculated for the compound. The calculated HOMO–LUMO energies using… read more here.
Keywords: computational investigation; quantum computational; methyl phenoxybenzylidene; investigation methoxyphenyl ... See more keywords
Quantum Computational, Spectroscopic (FT-IR, FT-Raman, NMR, and UV–Vis) Hirshfeld Surface and Molecular Docking-Dynamics Studies on 5-Hydroxymethyluracil (Monomer and Trimer)
Sign Up to like & getrecommendations! Published in 2023 at "Molecules"
DOI: 10.3390/molecules28052116
Abstract: For many decades, uracil has been an antineoplastic agent used in combination with tegafur to treat various human cancers, including breast, prostate, and liver cancer. Therefore, it is necessary to explore the molecular features of… read more here.
Keywords: molecular docking; quantum computational; computational spectroscopic; hirshfeld surface ... See more keywords