TY - JOUR
T1 - Neat ionic liquids
T2 - Versus ionic liquid mixtures: A combination of experimental data and molecular simulation
AU - Gouveia, Andreia S.L.
AU - Bernardes, Carlos E.S.
AU - Lozinskaya, Elena I.
AU - Shaplov, Alexander S.
AU - Canongia Lopes, José N.
AU - Marrucho, Isabel M.
PY - 2019/1/1
Y1 - 2019/1/1
N2 - Simple mixtures of ionic liquids (IL-IL mixtures) can become a promising approach for the substitution of task-specific ILs. Such a concept was explored in this article by comparison of the thermophysical properties of neat 1-ethyl-3-methylimidazolium 2,2,2-trifluoromethylsulfonyl-N-cyanoamide, [C2mim][TFSAM], and equimolar mixtures of two structurally similar ILs having more common ions. Molecular dynamics (MD) simulations were additionally used to further highlight structural aspects of these systems at a molecular level.
AB - Simple mixtures of ionic liquids (IL-IL mixtures) can become a promising approach for the substitution of task-specific ILs. Such a concept was explored in this article by comparison of the thermophysical properties of neat 1-ethyl-3-methylimidazolium 2,2,2-trifluoromethylsulfonyl-N-cyanoamide, [C2mim][TFSAM], and equimolar mixtures of two structurally similar ILs having more common ions. Molecular dynamics (MD) simulations were additionally used to further highlight structural aspects of these systems at a molecular level.
UR - http://www.scopus.com/inward/record.url?scp=85074304775&partnerID=8YFLogxK
U2 - 10.1039/c9cp03021b
DO - 10.1039/c9cp03021b
M3 - Article
C2 - 31617553
AN - SCOPUS:85074304775
VL - 21
SP - 23305
EP - 23309
JO - Physical Chemistry Chemical Physics
JF - Physical Chemistry Chemical Physics
SN - 1463-9076
IS - 42
ER -