Inside Cover: Molecular Simulations of Fatty-Acid Methyl Esters and Representative Biodiesel Mixtures (ChemPhysChem 13/2015)

Authors

  • Vivek S. Bharadwaj,

    1. Chemical and Biological Engineering Department, Colorado School of Mines, 1500 Illinois Street, Golden, CO 80401 (USA)
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  • Nathaniel M. Eagan,

    1. Chemical and Biological Engineering Department, Colorado School of Mines, 1500 Illinois Street, Golden, CO 80401 (USA)
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  • Nicholas M. Wang,

    1. Chemical and Biological Engineering Department, Colorado School of Mines, 1500 Illinois Street, Golden, CO 80401 (USA)
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  • Prof. Matthew W. Liberatore,

    1. Chemical and Biological Engineering Department, Colorado School of Mines, 1500 Illinois Street, Golden, CO 80401 (USA)
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  • Prof. C. Mark Maupin

    Corresponding author
    1. Chemical and Biological Engineering Department, Colorado School of Mines, 1500 Illinois Street, Golden, CO 80401 (USA)
    • Chemical and Biological Engineering Department, Colorado School of Mines, 1500 Illinois Street, Golden, CO 80401 (USA)

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Abstract

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Molecular dynamics simulations using a charge modified general amber force field reveal dimer-based molecular ordering in biodiesel systems that are driven by interactions between ester head-groups. More details can be found in the Full Paper by C. M. Maupin et al. on page 2810 in Issue 13, 2015 (DOI: 10.1002/cphc.201500453).

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