화학공학소재연구정보센터
검색결과 : 100건
No. Article
1 Expanding the Applications of the SAFT-gamma Mie Group-Contribution Equation of State: Prediction of Thermodynamic Properties and Phase Behavior of Mixtures
Haslam AJ, Gonzalez-Perez A, Di Lecce S, Khalit SH, Perdomo FA, Kournopoulos S, Kohns M, Lindeboom T, Wehbe M, Febra S, Jackson G, Adjiman CS, Galindo A
Journal of Chemical and Engineering Data, 65(12), 5862, 2020
2 Modeling the Fluid-Phase Equilibria of Semifluorinated Alkanes and Mixtures of (n-Alkanes plus n-Perfluoroalkanes) with the SAFT-gamma Mie Group-Contribution Approach
Morgado P, Barras J, Galindo A, Jackson G, Filipe EJM
Journal of Chemical and Engineering Data, 65(12), 5909, 2020
3 Ligand Design for N,O- or N,N-Pyrazolone-Based Hydrazones Ruthenium(II)-Arene Complexes and Investigation of Their Anticancer Activity
Pettinari R, Marchetti F, Di Nicola C, Pettinari C, Galindo A, Petrelli R, Cappellacci L, Cuccioloni M, Bonfili L, Eleuteri AM, da Silva MFCG, Pombeiro AJL
Inorganic Chemistry, 57(22), 14123, 2018
4 SAFT-gamma Force Field for the Simulation of Molecular Fluids. 5. Hetero-Group Coarse-Grained Models of Linear Alkanes and the Importance of Intramolecular Interactions
Rahman S, Lobanova O, Jimenez-Serratos G, Braga C, Raptis V, Muller EA, Jackson G, Avendano C, Galindo A
Journal of Physical Chemistry B, 122(39), 9161, 2018
5 Exfoliation, reduction, hybridization and polymerization mechanisms in one-step microwave-assist synthesis of nanocomposite nylon-6/graphene
Gonzalez-Morones P, Hernandez-Hernandez E, Fernandez-Tavizon S, Ledezma-Rodriguez R, Saenz-Galindo A, Cadenas-Pliego G, Avila-Orta CA, Ziolo RF
Polymer, 146, 73, 2018
6 A QM-CAMD approach to solvent design for optimal reaction rates
Struebing H, Obermeier S, Siougkrou E, Adjiman CS, Galindo A
Chemical Engineering Science, 159, 69, 2017
7 Development of Predictive Models of the Kinetics of a Hydrogen Abstraction Reaction Combining Quantum-Mechanical Calculations and Experimental Data
Diamanti A, Adjiman CS, Piccione PM, Rea AM, Galindo A
Industrial & Engineering Chemistry Research, 56(4), 815, 2017
8 Predicting the Solvation of Organic Compounds in Aqueous Environments: From Alkanes and Alcohols to Pharmaceuticals
Hutacharoen P, Dufal S, Papaioannou V, Shanker RM, Adjiman CS, Jackson G, Galindo A
Industrial & Engineering Chemistry Research, 56(38), 10856, 2017
9 Cytotoxic Half-Sandwich Rh(III) and Ir(III) beta-Diketonates
Petrini A, Pettinari R, Marchetti F, Pettinari C, Therrien B, Galindo A, Scopelliti R, Riedel T, Dyson PJ
Inorganic Chemistry, 56(21), 13600, 2017
10 Predicting the Fluid-Phase Behavior of Aqueous Solutions of ELP (VPGVG) Sequences Using SAFT-VR
Zhao BW, Lindeboom T, Benner S, Jackson G, Galindo A, Hall CK
Langmuir, 33(42), 11733, 2017