Publicaciones en colaboración con investigadores/as de Universidad del País Vasco/Euskal Herriko Unibertsitatea (12)

2017

  1. Bimodal supramolecular functionalization of carbon nanotubes triggered by covalent bond formation

    Chemical Science, Vol. 8, Núm. 3, pp. 1927-1935

  2. Libvdwxc: A library for exchange-correlation functionals in the vdW-DF family

    Modelling and Simulation in Materials Science and Engineering, Vol. 25, Núm. 6

2016

  1. Recent developments in the ABINIT software package

    Computer Physics Communications, Vol. 205, pp. 106-131

2014

  1. Gas sensing and thermal transport through carbon-nanotube-based nanodevices

    Challenges and Advances in Computational Chemistry and Physics (Springer), pp. 99-136

2012

  1. The ETSF: An e-infrastructure that bridges simulations and experiments

    Computing in Science and Engineering, Vol. 14, Núm. 1, pp. 22-32

  2. Wannier functions approach to van der Waals interactions in ABINIT

    Computer Physics Communications, Vol. 183, Núm. 3, pp. 480-485

2011

  1. Organizing software growth and distributed development: The case of abinit

    Computing in Science and Engineering, Vol. 13, Núm. 1, pp. 62-69

2010

  1. Carbon nanotube based sensors and fluctuation enhanced sensing

    Physica Status Solidi (C) Current Topics in Solid State Physics

  2. Increasing chemical selectivity of carbon nanotube-based sensors by fluctuation-enhanced sensing

    Fluctuation and Noise Letters, Vol. 9, Núm. 3, pp. 277-287

2009

  1. ABINIT: First-principles approach to material and nanosystem properties

    Computer Physics Communications, Vol. 180, Núm. 12, pp. 2582-2615

2008

  1. Sharing electronic structure and crystallographic data with ETSF_IO

    Computer Physics Communications, Vol. 179, Núm. 10, pp. 748-758

  2. Specification of an extensible and portable file format for electronic structure and crystallographic data

    Computational Materials Science, Vol. 43, Núm. 4, pp. 1056-1065