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Creators/Authors contains: "Petrosyan, Lyudvig S"

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  1. Engheta, Nader; Noginov, Mikhail A; Zheludev, Nikolay I (Ed.)
    We present an analytical model for Förster resonance energy transfer between donors and acceptors in the presence of a metal surface. We find that energy transfer to the metal results in a reduction of the Förster radius, leading to a suppression of concentration quenching for high molecule concentrations. 
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  2. The quasi-two-dimensional exciton subsystem in CdSe nanoplatelets is considered. It is theoretically shown that Bose–Einstein condensation (BEC) of excitons is possible at a nonzero temperature in the approximation of an ideal Bose gas and in the presence of an “energy gap” between the ground and the first excited states of the two-dimensional exciton center of inertia of the translational motion. The condensation temperature increases with the width of the “gap” between the ground and the first excited levels of size quantization. It is shown that when the screening effect of free electrons and holes on bound excitons is considered, the BEC temperature of the exciton subsystem increases as compared to the case where this effect is absent. The energy spectrum of the exciton condensate in a CdSe nanoplate is calculated within the framework of the weakly nonideal Bose gas approximation, considering the specifics of two-dimensional Born scattering. 
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  3. Abstract Cross‐linked block copolymers are structurally complex, and utilization of traditional methods of molecular representation in chemoinformatics is only of limited applicability. Therefore, we introduced new techniques of structural representation for block copolymers. We developed additive and combinatorial approaches that treat a copolymer as a mixture system. In this approach, DRAGON descriptors are concentration‐weighted for all chemicals in the reaction mixture. As a proof of concept, we have studied glass transition temperatures of block copolymers of hydroxyalkyl‐ and dihydroxyalkyl carbamate terminated poly(dimethylsiloxane) oligomers with poly(‐caprolactone) and developed four quantitative structure‐property relationships (QSPR) models. The correlation coefficient (R2) for mentioned QSPR models ranges from 0.851 to 0.911 for the training set. In addition to the newly introduced technique we found that the octanol−water partition coefficient and 3D‐MoRSE unweighted descriptors were the most important descriptors for the studied property. The results of the study demonstrated that all chemicals in reaction mixture influenced the glass transition temperatures. 
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