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1 January 1998 Prediction of columnar mesomorphism by molecular parameters: novel series of disklike molecular structures
Alla Bronnikova, Olga Akopova
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Proceedings Volume 3319, Liquid Crystals: Chemistry and Structure; (1998) https://doi.org/10.1117/12.301256
Event: Liquid Crystals, 1997, Zakopane, Poland
Abstract
To continue previous works on prediction of discotic mesomorphism (DM) new selection has been investigated for disc-like compounds based on polysubstituted cyclotriveratrylene and tetrabenzocyclophane types. The following molecular parameters have been computed: K, Kc, K8, Kp,Mm, Mr and the mesophase appearance prediction probabilities have been estimated by specified ones. The analysis of 150 hypothetical structures was carried out and the part of them with predicted DM was chosen for further investigations.
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Alla Bronnikova and Olga Akopova "Prediction of columnar mesomorphism by molecular parameters: novel series of disklike molecular structures", Proc. SPIE 3319, Liquid Crystals: Chemistry and Structure, (1 January 1998); https://doi.org/10.1117/12.301256
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KEYWORDS
Statistical analysis
Molecules
Chromium
Computer simulations
Crystals
Krypton
Optical spheres
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