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Published on: August 30, 2019
Succinic acid in aqueous solution: connecting microscopic surface composition and macroscopic surface tension
Josephina Werner1, Jan Julin, Maryam Dalirian
1Department of Physics and Astronomy, Uppsala University, P.O. Box 516, SE-751 20 Uppsala, Sweden. josephina.werner@physics.uu.se.
Succinic acid concentrates at the water surface, unlike its deprotonated form. This surface enrichment explains the reduced surface tension in aqueous solutions, impacting atmospheric models.
Area of Science:
- Physical Chemistry
- Surface Science
- Computational Chemistry
Background:
- Understanding the behavior of molecules at interfaces is crucial for various scientific disciplines.
- The surface tension of aqueous solutions is a fundamental macroscopic property influenced by molecular interactions.
- Succinic acid's behavior at the air-water interface requires detailed investigation.
Purpose of the Study:
- To investigate the interfacial behavior of succinic acid in aqueous solutions.
- To quantify the surface excess concentration of succinic acid and its deprotonated form.
- To correlate surface enrichment with the reduction in surface tension.
Main Methods:
- Surface-sensitive X-ray photoelectron spectroscopy (XPS) for experimental analysis.
- Molecular dynamics (MD) simulations for detailed molecular-level insights.
- Varying pH and bulk concentrations to study different solution conditions.
Main Results:
- Succinic acid preferentially accumulates at the water-vapor interface.
- The deprotonated form of succinic acid is depleted from the surface due to hydration.
- Surface concentration of succinic acid was quantified and found to saturate the interface at high bulk concentrations.
- Enrichment factors were calculated and used to model surface tension reduction.
Conclusions:
- Succinic acid's surface activity is driven by its molecular structure, favoring the non-dissociated form at the interface.
- A direct correlation exists between succinic acid's surface enrichment and the observed decrease in surface tension.
- The findings provide microscopic insights into surface tension and have implications for atmospheric modeling.
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