Peacemaker 2: Making clusters talk about binary mixtures and neat liquids
نویسندگان
چکیده
منابع مشابه
Solvatochromic Study on Binary Solvent Mixtures with Ionic Liquids
Solvent effects on 2,6-dichloro-4-(2,4,6-triphenyl-pyridinium-1-yl)phenolate [ET (33) dye] and 7diethylamino-3,4-benzophenoxazine-2-one (Nile Red) in binary mixtures of organic solvents (acetone, acetonitrile, propylene carbonate, methanol and ethane-1,2-diol) with 1,3-dialkyl imidazoliumbased ionic liquids were studied by UV-visible spectroscopy. Highly nonlinear behaviour of mixtures of alcoh...
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The viscosity (η) of four binary mixtures (ionic liquids plus molecular solvents, ILs+MSs) was measured in the 283.15 < T/K < 363.15 temperature range. Different IL/MS combinations were selected in such a way that the corresponding η(T) functions exhibit crossover temperatures at which both pure components present identical viscosity values. Consequently, most of the obtained mixture isotherms,...
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The density and viscosity values at T= (293.15 to 323.15) K for binary mixtures of nitromethane with 2-propanol, 2-butanol and 2-pentanol were measured over the entire composition range. From the experimental data, excess molar volumes, thermal expansion coefficients, excess thermal expansions, partial molar volumes at infinite dilution and deviations in viscosity were calculated. The results w...
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The solvation characteristic of 2-methoxy-4-aminobenzoic acid methyl ester (MABAE) and 2methoxy-4-dimethylaminobenzoic acid methyl ester (MDABAE) in the S0, S1(LE) and S1(ICT) states has been determined by means of solvatochromic shifts in neat and binary solvent mixtures. The multiple linear regression analysis of Kamlet et al. indicates that non-specific dielectric dipoledipole and specific h...
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ژورنال
عنوان ژورنال: SoftwareX
سال: 2018
ISSN: 2352-7110
DOI: 10.1016/j.softx.2018.11.002