Local response dispersion method in periodic systems: Implementation and assessment

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Adapting Taylor Dispersion to Measure the Dispersion Coefficient of Electrolyte Solutions via an Accessible Microfluidic Setup
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Yasuhiro Ikabata1, Yusuke Tsukamoto, Yutaka Imamura

  • 1Department of Chemistry and Biochemistry, School of Advanced Science and Engineering, Waseda University, 3-4-1 Okubo, Shinjuku-ku, Tokyo, 169-8555, Japan.

Journal of Computational Chemistry
|December 10, 2014
PubMed

Keywords:
density functional theorydispersion forceperiodic boundary conditionphysical adsorptionplane-wave basis set

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