J N Canongia Lopes
Also known as: J N A C Lopes, J N C Lopes
Centro de Química Estrutural, Instituto Superior Técnico / Universidade de Lisboa, Imperial College London, Universidade Técnica de Lisboa Instituto Superior Técnico
Research areas: Chemistry · Physical and Theoretical Chemistry · Ionic liquids properties and applications · Phase Equilibria and Thermodynamics · Thermodynamic properties of mixtures
About
Generally my friends and colleagues call me Zé Nuno. For those unfamiliar with Portuguese, “Zé” (pronounced “zed” with no “d”) is the short name for “José”. I also use my second name (Nuno) to avoid confusion with the many other Portuguese “Zé”s.
I graduated in Chemical Engineering from Instituto Superior Técnico - Universidade Técnica de Lisboa (IST-UTL), Portugal, in 1989 and obtained my PhD in Chemical Thermodynamics from the same institution in 1993. I was a post-doc at the Chemistry Department of Imperial College London, UK (1996). Currently I am Full Professor of Physical Chemistry at IST - Universidade de Lisboa (IST-UL).
My research is carried out at Centro de Química Estrutural (CQE/IST-UL) and is centered on molecular modeling of complex fluids and materials, (e.g. ionic liquids, cement clinkers, carbon aggregates). Since January 2019 I am the director of CQE.
Employment
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Centro de Química Estrutural Director2019 - Present
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Instituto Superior Técnico / Universidade de Lisboa Professor Catedrático
Education
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Imperial College London Post-Doc Researcher1995 - 1996
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Universidade Técnica de Lisboa Instituto Superior Técnico PhD in Chemical Thermodynamics1989 - 1993
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Universidade Técnica de Lisboa Instituto Superior Técnico Licenciatura em Engenharia Química (~MEng in Chemical Engineering)1983 - 1988
Projects & Funding
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Redes de coordenação de antibióticos como forma de potenciar a bioactividade dos fármacos N/A2018 - Present
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Nanoestrutura em Líquidos Iónicos: Fundamentos e Aplicações N/A2018 - Present
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Inteligência Artificial Aplicada à Previsão de Equilíbrio de Fases N/A2018 - Present
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Financiamento plurianual do Centro de Química Estrutura N/A2018 - Present
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Sistemas de Transporte Sustentáveis: Produção e Armazenamento de Energia usando Líquidos Iónicos N/A2018 - Present
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Nanomateriais de Carbono e Líquidos Iónicos: Do conhecimento fundamental a aplicações tecnológicas sustentáveis N/A2014 - 2017
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Nanoengenharia do silicato de cálcio hidratadoadIST/CIMPOR Nanocement 2012/2015 N/A2012 - 2018
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Caracterização termofísica de novos líquidos iónicos à temperatura ambiente N/A2012 - 2015
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Tensionamento de Líquidos iónicos N/A2012 - 2015
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Room temperature ionic liquids under negative pressure conditions: experimental and simulation studies N/A2010 - 2013
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Modelling and Analysis of Nanostructures: Carbon Nanotubes and Nanocomposite Materials N/A2010 - 2013
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Molecular Modeling of Ionic Liquids: from Structure to Thermodynamics N/A2009 - 2012
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Anchoring Basic Parameters for Fundamental Predictive Models in Liquid Salt Systems N/A2008 - 2011
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Petroleum-derived hydrocarbons in ionic liquids N/A2008 - 2014
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Thermodynamical and Structural Characterization of Ionic Liquids and other Associated Fluids Fundação para a Ciência e a Tecnologia2007 - 2009
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Gas Phase Reactions on Ionic Liquids N/A2007 - 2010
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Vapour Liquid Equilibrium of Pure Ionic Liquids and their Mixtures with Organic Solvents N/A2007 - Present
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Wetting behaviour of room-temperature ionic liquids N/A2007 - 2010
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Modelling the Energetics and Structure of Solid Metallocenes Fundação para a Ciência e a Tecnologia2005 - 2008
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Estudo das propriedades físico-químicas de líquidos iónicos com hidrocarbonetos derivados do petróleo N/A2005 - 2009
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Molecular Modeling of New Fluids with Technological Applications N/A2003 - 2007
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Modelação molecular de novos fluidos com interesse tecnológico N/A2002 - 2004
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Thermodynamics of Critical Phenomena in Binary Liquid-Liquid Equilibria: Simulation, Theory e Experiments N/A2000 - 2003
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Potenciais Intermoleculares e simulação Computacional de Fluidos Moleculares N/A1999 - 2002
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Phase Equilibria and Surface Properties in Mixtures containing Partially Fluorinated Hydrocarbons N/A1997 - 2000
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Thermodynamic Properties of Simple Mixtures N/A1997 - 2000
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Thermodynamics of Argon Isotopes N/A1993 - 1995
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Isotope Effects in Mixtures N/A1990 - 1992
Publications (237)
- Understanding and optimizing the structure of novel peptide-based ionic liquids: Water as modulating agent Save
- Charge Distribution-Driven Organization in Ionic Liquids Save
- Depicting a neoteric family of biocompatible ionic liquids: A look through a molecular dynamics prism Save
- Robust Method for Property Prediction via Artificial Neural Networks: Incorporating Key Structural Features for Carbon Dioxide–Ionic Liquid Mixtures Save
- Rational design of halo-imidazolium-based ionic liquids: tailoring the charge distribution to mimic the structure of real charge inverted analogues Save
- To mix or not to mix: charge and polarity effects on alkyl/fluoroalkyl compound miscibility Save
- Unraveling the Morphology of [CnC1Im]Cl Ionic Liquids Combining Cluster and Aggregation Analyses Save
- Molecular Interactions between Ionic Liquid Lubricants and Silica Surfaces: An MD Simulation Study Save
- Perfluorinated Alcohols at High Pressure: Experimental Liquid Density and Computer Simulations Save
- Water Solubility Trends in Ionic Liquids: The Quantitative Structure–Property Relationship Model versus Molecular Dynamics Save
- Tailoring amphotericin B as an ionic liquid: an upfront strategy to potentiate the biological activity of antifungal drugs Save
- Vapor Pressure Assessment of Sulfolane-Based Eutectic Solvents: Experimental, PC-SAFT, and Molecular Dynamics Save
- Photon Upconversion in TTA-Inducing Ionic Liquids: Pinpointing the Role of IL Nanostructured Media Using MD Simulations Save
- Solvate ionic liquids based on lithium bis(trifluoromethanesulfonyl)imide–glyme systems: coordination in MD simulations with scaled charges Save
- Tuning the miscibility of water in imide-based ionic liquids Save
- Evidences for a Null Molar Volume Contribution by Hydroxyl Groups in Ammonium Bistriflimide-Based Ionic Liquids Save
- Transferable, Polarizable Force Field for Ionic Liquids Save
- Ionic Liquids in Wonderland: From Electrostatics to Coordination Chemistry Save
- Neat ionic liquids versus ionic liquid mixtures: a combination of experimental data and molecular simulation Save
- Negative Pressure Regimes in Ionic Liquids: Structure and Interactions in Stretched Liquids as Probed by NMR Save