Surface pKa of Saturated Carboxylic Acids at the Air/Water Interface: A Quantum Chemical Approach
| Autor: | Valentin B. Fainerman, Yuri B. Vysotsky, E. S. Kartashynska, Dieter Vollhardt |
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| Rok vydání: | 2020 |
| Předmět: |
Quantum chemical
Surface (mathematics) Materials science Interface (Java) Air water interface 02 engineering and technology 010402 general chemistry 021001 nanoscience & nanotechnology 01 natural sciences 0104 chemical sciences Surfaces Coatings and Films Electronic Optical and Magnetic Materials General Energy Chemical physics Monolayer Physical and Theoretical Chemistry 0210 nano-technology |
| Zdroj: | The Journal of Physical Chemistry C |
| ISSN: | 1932-7455 1932-7447 |
| Popis: | In the present study a theoretical approach is proposed for the pKa estimation of monolayers at the air/water interface on the basis of saturated carboxylic acids. This model involves calculating o... |
| Databáze: | OpenAIRE |
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