Projects per year
Personal profile
Willing to supervise PhD
The Computational Design of Nanostructured Biomimetic Catalysts
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Adsorption
Chemical Compounds
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Chemical Compounds
adsorption
Physics & Astronomy
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Chemical Compounds
Volatile Organic Compounds
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Silica
Engineering & Materials Science
Molecules
Chemical Compounds
simulation
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Projects 2018 2020
IAA3 - Centre for Advanced Separations Engineering Industrial Engagement/Networking Event
Perera, S., Bird, M., Castro Dominguez, B., Chew, Y., Duren, T., Eslava Fernandez, S., Herdes Moreno, C., Lennox, M., Mattia, D. & Mays, T.
2/01/18 → 31/03/20
Project: Research council
Soumaya-inspired catalytic membranes for H2 production
Castro Dominguez, B. & Herdes Moreno, C.
Project: Research-related funding
Research Output 2004 2018
Combined experimental, theoretical and molecular simulation approach for the description of the fluid phase behavior of hydrocarbon mixtures within shale rocks
Herdes, C., Petit, C., Mejía, A. & Müller, E. A. 17 May 2018 In : Energy & Fuels. 32, 5, p. 5750-5762Research output: Contribution to journal › Article
Open Access
Phase behavior
Shale
Hydrocarbons
Nanopores
Rocks
Crystallization processes in bi-component thin film depositions: towards a realistic Kinetic Monte-Carlo simulation
Martínez-Martínez, D., Herdes, C. & Vega, L. F. 15 Jun 2018 In : Surface & Coatings Technology. 343, p. 38-48 11 p.Research output: Contribution to journal › Article
Crystallization
crystallization
Thin films
Kinetics
kinetics
The Porogen Effect on the Complexation Step of Trinitrotoluene-Methacrylic Acid: Towards Efficient Imprinted Polymer Sensors
Bird, L. & Herdes, C. 28 Feb 2018 In : Molecular Systems Design & Engineering. 3, 1, p. 89-95 9 p.Research output: Contribution to journal › Article
Open Access
Trinitrotoluene
Complexation
Polymers
Dimethyl sulfoxide
Acids
Towards sustainable micro-pollutants’ removal from wastewaters: caffeine solubility, self-diffusion and adsorption studies from aqueous solutions into hydrochars
Román, S., Ledesma, B., Álvarez, A. & Herdes, C. 18 Aug 2018 In : Molecular Physics. 116, 15-16, p. 2129-2141 13 p.Research output: Contribution to journal › Article
caffeine
Waste Water
Caffeine
Solubility
Adsorption
2
Citations
Group-contribution coarse-grained molecular simulations of polystyrene melts and polystyrene solutions in alkanes using the SAFT-γ force field
Jiménez-Serratos, G., Herdes, C., Haslam, A. J., Jackson, G. & Müller, E. A. 27 Jun 2017 In : Macromolecules. 50, 12, p. 4840-4853 42 p., ma-2016-02072vResearch output: Contribution to journal › Article
Open Access
File
Alkanes
Polystyrenes
Paraffins
Phase behavior
Toluene