Excess thermodynamic properties such as viscosity deviation (ln ∆ƞ), excess isentropic compressibility (KsE), excess molar volume (VmE), excess intermolecular free length (LfE), excess free volume (VfE), excess acoustic ...

The electrostatic potential (V(r)), the average local ionization energy (I(r)), the relative hardness (ηrel), the electron affinity (EA), the ionization potential (IP), the electronegativity (χ), the hardness (η) and the ...

Deep eutectic solvents (DESs) and ionic liquids have been considered organic solvents and applied in numerous chemical procedures. DESs usually are produced by combining 2 or 3 organic components. DES can be formed in a ...

In current study, ternary phase equilibria of (water + n-butyric acid + 2-methylcyclohexanol) were considered. Experimental tie-line data were measured at T = 298.2, 308.5 and 318.2 K and 102.1 kPa. Type I LLE behavior was ...

The density, refractive index, and electrical conductivity of binary and ternary mixtures containing sulfolane (2) + 1, 3-butanediol (1) + lithium perchlorate or sodium perchlorate or ammonium perchlorate were measured at ...

3D-QSAR has indeed established itself as a very useful component in the design of compounds with biological potential. The use of this tool will therefore make it possible to more easily target the modulations to be carried ...

Our present study provides a detailed knowledge on structure and spectroscopic properties of 2-ethyl-2-phenyl malonamide. The optimized geometrical parameters, vibrational wavenumbers and electronic spectra have been ...

In this work, a simple method was employed to prepare MnO2 nanoparticles and characterized by various techniques, including X-ray diffraction (XRD), Fourier transform infrared spectroscopy (FTIR), and atomic force microscope ...

Biochar is an adsorbent material widely used to remove pollutants from industrial discharges. This research focuses on the adsorption capacity of Biochar, obtained by thermal decomposition of Argan shells, to remove methylene ...