Analysis of pair interaction in a bipolar mesogen 4-(4-hydroxylbutyloxy)-4′-cyano-biphenyl: A comparative study based on semiempirical and DFT methods-Reference-Cited by-同舟云学术

Analysis of pair interaction in a bipolar mesogen 4-(4-hydroxylbutyloxy)-4′-cyano-biphenyl: A comparative study based on semiempirical and DFT methods

Published:2011-01-13 Issue:15 Volume:111 Page:4113-4123
ISSN:0020-7608
Container-title:International Journal of Quantum Chemistry
language:en
Short-container-title:Int. J. Quantum Chem.

Author:

Roychoudhury Mihir,Srivastav Rakesh Kumar

Publisher

Wiley

Subject

Physical and Theoretical Chemistry,Condensed Matter Physics,Atomic and Molecular Physics, and Optics

Link

http://onlinelibrary.wiley.com/wol1/doi/10.1002/qua.22970/fullpdf

Reference28 articles.

1. Towardsin SilicoLiquid Crystals. Realistic Transition Temperatures and Physical Properties forn-Cyanobiphenyls via Molecular Dynamics Simulations

2. Odd-Even Effects in Homologous Series of 4-Cyano-4'-Alkylbiphenyls(nCB): Role of Anisotropic Pair Potential

3. Odd-even Effect in a Homologous Series of 4-n-Alkylbenzoic Acids: Role of Anisotropic Pair Potential

4. Order of a Thermotropic Mesogen: HCCPP-A Statistical Study Based on Quantum Mechanics and Computer Simulation

5. Shukla , A. P. Galy , A. M. Brouant , P. Galy , J. P. Soyfer , J. C. Barbe , J. Presented at the VII International Symposium on Medicinal Chemistry Proceedings 2 Swedish Pharmaceutical Press Stockholm 1985 213

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