Exploració per tema "Grafé"

Ara es mostren els items 1-7 de 7

    • Characterization of the methane–graphene hydrophobic interaction in aqueous solution from ab initio simulations 

      Calero Borrallo, Carles; Martí Rabassa, Jordi; Guàrdia Manuel, Elvira; Masia, Marco (2013-09-17)
      Article
      Accés restringit per política de l'editorial
      In this article, the interaction between a methane molecule and a graphene plane in liquid water has been characterized employing DFT-based free energy Molecular Dynamics calculations. This system represents a good model ...

    • Construction of free-standing films using graphene for biomedical applications 

      Biurrun Zuasti, Maialen (Universitat Politècnica de Catalunya / Zhejiang University, 2011)
      Projecte Final de Màster Oficial
      Accés restringit per decisió de l'autor
      The LbL Electrostatic Self Assembly could be used to produce nano or micrometric thickness multilayer films with several different functionalities and applications. It is based on the alternative dipping of a substrate in ...

    • El Grafeno. Parte II: procesos y viabilidad de su producción 

      Mayora Curzio, Carlos A.; Cremades Oliver, Lázaro Vicente; Cusidó Fàbregas, Joan Antoni (2015-07)
      Article
      Accés obert
      Ante el descubrimiento del grafeno, un material con propiedades de gran interés tecnológico, la industria busca optimizar sus mecanismos de producción con el objetivo de abordar un mercado para el cual se prevé un gran ...

    • H-2 physisorbed on graphane 

      Carbonell Coronado, Carmen; De Soto Borrera, Feliciano Carlos; Cazorla Silva, Claudio; Boronat Medico, Jordi; Gordillo Bargueño, Maria Carmen (2013-06)
      Article
      Accés obert
      We study the zero-temperature phase diagrams of H2 adsorbed on the three structures predicted for graphane (chair, boat and washboard graphane), using a diffusion Monte Carlo technique. Graphane is the hydrogenated version ...

    • Molecular-free synthesis of multifunctional graphene oxide-copper sulfide nanocomposite gels 

      Ross, Nils (Universitat Politècnica de Catalunya, 2021-07-22)
      Projecte Final de Màster Oficial
      Accés restringit per acord de confidencialitat

    • Second layer of H2 and D2 adsorbed on graphene 

      Gordillo Bargueño, Maria Carmen; Boronat Medico, Jordi (2013-04-03)
      Article
      Accés obert
      We report diffusion Monte Carlo calculations on the phase diagrams of para-H2 and ortho-D2 adsorbed on top of a first layer of the same substances on graphene. We found that the ground state of the second layer is a ...

    • Zero-temperature phase diagram of D2 physisorbed on graphane 

      Carbonell Coronado, Carmen; De Soto Borrera, Feliciano Carlos; Cazorla Silva, Claudio; Boronat Medico, Jordi; Gordillo Bargueño, Maria Carmen (Institute Of Physics Publishing Ltd, 2013-10-06)
      Article
      Accés restringit per política de l'editorial
      We determined the zero-temperature phase diagram of D2 physisorbed on graphane using the diffusion Monte Carlo method. The substrate used was C-graphane, an allotropic form of the compound that has been experimentally ...