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Ternary Mixed Micelle Hexadecyltrimethylammonium Bromide—Dodecyltrimethylammonium Bromide—Sodium Deoxycholate: Gibbs Free Energy of Mixing and Excess Gibbs Energy of Mixing [PDF]
Molecules, 2023 Pharmaceutical, food, and cosmetic formulations often contain binary or ternary surfactant mixtures with synergistic interactions amongst micellar building blocks.
Ana Pilipović +4 more
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Gibbs free energy and Helmholtz free energy for a three-dimensional Ising-like model [PDF]
Condensed Matter Physics, 2011 The critical behavior of a 3D Ising-like system is studied at the microscopic level of consideration. The free energy of ordering is calculated analytically as an explicit function of temperature, an external field and the initial parameters of the model.
R.V. Romanik, M.P. Kozlovskii
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Gibbs Free Energy and Reaction Rate Acceleration in and on Microdroplets [PDF]
Entropy, 2019 Recent observations show that many reactions are accelerated in microdroplets compared to bulk liquid and gas media. This acceleration has been shown to feature Gibbs free energy changes, ΔG, that are negative and so reaction enabling, compared to ...
Adrian F Tuck
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Molecular Merged Hypergraph Neural Network for Explainable Solvation Gibbs Free Energy Prediction [PDF]
ResearchSolvation free energies play a fundamental role in various fields of chemistry and biology. Accurately determining the solvation Gibbs free energy ([Formula: see text]) of a molecule in a given solvent requires a deep understanding of the intrinsic ...
Wenjie Du +8 more
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LFER and the Effect of Temperature on Oxyanion Adsorption by Goethite [PDF]
E3S Web of Conferences, 2019 A linear relationship between the Gibbs free energy, ΔGr,H+, of the aqueous complex deprotonation reaction, and the Gibbs free energy, ΔGr,ads, of bidentate surface complexation reaction of oxyanions was derived from modelling of temperature dependent ...
Dabizha Anna +2 more
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Heliyon, 2020 After adsorption and penetration, a virus hijacks a cell's metabolic machinery and uses it as a medium for its reproduction and growth through multiplication.
Marko Popovic, Mirjana Minceva
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Crystals, 2023 Electrochemical nitrate reduction to ammonia is an efficient strategy for nitrate removal and ammonia production in ambient conditions. TiO2 is a promising electrocatalyst for such a reaction, but chemical doping is still needed to further improve the ...
Xiyu He +4 more
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Fast free energy estimates from λ-dynamics with bias-updated Gibbs sampling
Nature Communications, 2023 Relative binding free energy calculations have become an integral computational tool for lead optimization in structure-based drug design. Classical alchemical methods, including free energy perturbation or thermodynamic integration, compute relative ...
Michael T. Robo +4 more
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Kuangchan zonghe liyong, 2023 This is an essay in the field of metallurgical engineering. Thermodynamics of the reaction, hydrochloric acid leaching for waste ceria-based rare earth polishing powder, was studied in this work.The influences on the leaching rate of the waste polishing ...
Shuo Dong +4 more
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Gibbs Free Energy of Formation of Synthetic Cryptomelane
CHIMIA, 1984 Cryptomelane with a formal composition of K0.88Mn(III)0.24Mn(IV)7.60O16.00∙0.33H2O was precipitated from a solution of sulfuric acid containing dissolved manganese sulfate.
Raphael Hypólito +3 more
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