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List of works by Carmelo Herdes

Computer simulation of volatile organic compound adsorption in atomistic models of molecularly imprinted polymers.

scientific article published in May 2009

Fundamental studies of methyl iodide adsorption in DABCO impregnated activated carbons.

scientific article published on 24 May 2013

Modelling the interfacial behaviour of dilute light-switching surfactant solutions

scientific article published on 26 December 2014

Molecular recognition effects in atomistic models of imprinted polymers.

scientific article published on 28 July 2011

Nitrogen Adsorption Studies on Non-Porous Silica: The Annealing Effect over Surface Non-Bridging Oxygen Atoms

Nitrogen and Water Adsorption in Aluminum Methylphosphonate α: A Molecular Simulation Study

scientific article published on 01 March 2006

Pore size distribution analysis of selected hexagonal mesoporous silicas by grand canonical Monte Carlo simulations.

scientific article published in September 2005

Predicting neopentane isosteric enthalpy of adsorption at zero coverage in MCM-41

scientific article published on 05 May 2011

Thermodynamic properties and aggregate formation of surfactant-like molecules from theory and simulation

scientific article published on 01 May 2004

Towards EMIC rational design: setting the molecular simulation toolbox for enantiopure molecularly imprinted catalysts

scientific article

Unusual flexibility of mesophase pitch-derived carbon materials: An approach to the synthesis of graphene

scholarly article in Carbon, vol. 115, May 2017

Volatile Organic Compound Adsorption on a Nonporous Silica Surface: How Do Different Probe Molecules Sense the Same Surface?

article

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