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Inside Cover: Molecular Simulations of Fatty‐Acid Methyl Esters and Representative Biodiesel Mixtures (ChemPhysChem 13/2015)
Author(s) -
Bharadwaj Vivek S.,
Eagan Nathaniel M.,
Wang Nicholas M.,
Liberatore Matthew W.,
Maupin C. Mark
Publication year - 2015
Publication title -
chemphyschem
Language(s) - English
Resource type - Reports
SCImago Journal Rank - 1.016
H-Index - 140
eISSN - 1439-7641
pISSN - 1439-4235
DOI - 10.1002/cphc.201500677
Subject(s) - molecular dynamics , biodiesel , dimer , fatty acid methyl ester , force field (fiction) , chemistry , cover (algebra) , computational chemistry , chemical physics , materials science , organic chemistry , physics , catalysis , mechanical engineering , engineering , quantum mechanics
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 ).