Dissertation/ Thesis

Theoretical and Computational Study of the Structure and Dynamics of Ionic Liquid Mixtures: Thermodynamical and Interfacial Properties

التفاصيل البيبلوغرافية
العنوان: Theoretical and Computational Study of the Structure and Dynamics of Ionic Liquid Mixtures: Thermodynamical and Interfacial Properties
المؤلفون: Docampo Álvarez, Borja
المساهمون: Gallego del Hoyo, Luis Javier, Varela Cabo, Luis Miguel, Universidade de Santiago de Compostela. Centro Internacional de Estudos de Doutoramento e Avanzados (CIEDUS), Universidade de Santiago de Compostela. Escola de Doutoramento Internacional en Ciencias e Tecnoloxía, Universidade de Santiago de Compostela. Programa de Doutoramento en Ciencia de Materiais
المجموعة: Minerva - Repositorio institucional da Universidade de Santiago de Compostela (USC)
مصطلحات موضوعية: ionic liquids, electrolyte, molecular dynamics, Materias::Investigación::22 Física::2204 Física de fluidos::220408 Líquidos, Materias::Investigación::22 Física::2205 Mecánica::220510 Mecánica estadística, Materias::Investigación::12 Matemáticas::1203 Ciencia de los ordenadores::120326 Simulación, Materias::Investigación::22 Física::2213 Termodinámica::221311 Fenómenos de transporte
الوصف: Ionic liquids (ILs) are nanostructured green solvents with very useful properties for a large number of applications, including synthesis and catalysis, electrochemistry, or energy storage. These properties are determined by the choice of anion and cation, and can be further fine-tuned for specific applications by means of mixing with molecular cosolvents or other ILs. This has resulted in them being known as "designer solvents." This thesis presents computer simulation studies, supplemented by experimental measurements, of mixtures of ILs with molecular cosolvents (water and alcohols) and other ILs, in order to understand their nanostructured mixing mechanisms in bulk mixtures and nanoconfined at the electrochemical interface.
نوع الوثيقة: doctoral or postdoctoral thesis
وصف الملف: application/pdf
اللغة: English
Relation: http://hdl.handle.net/10347/18262
الاتاحة: http://hdl.handle.net/10347/18262
Rights: Attribution-NonCommercial-NoDerivatives 4.0 Internacional ; http://creativecommons.org/licenses/by-nc-nd/4.0/ ; info:eu-repo/semantics/openAccess
رقم الانضمام: edsbas.13E3E29F
قاعدة البيانات: BASE