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Towards first-principles molecular design of liquid crystal-based chemoresponsive systems
oleh: Luke T. Roling, Jessica Scaranto, Jeffrey A. Herron, Huaizhe Yu, Sangwook Choi, Nicholas L. Abbott, Manos Mavrikakis
Format: | Article |
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Diterbitkan: | Nature Portfolio 2016-11-01 |
Deskripsi
Nematic liquid crystals have potential as sensors for various molecules. Here, the authors present a computational chemistry model for describing the detection of a warfare agent by liquid crystals, opening the door for the atomic-scale design of sensitive and selective chemoresponsive systems.