Publications in collaboration with researchers from Rutherford Appleton Laboratory (18)

2023

  1. Collective dynamics and self-motions in the van der Waals liquid tetrahydrofuran from meso- to inter-molecular scales disentangled by neutron spectroscopy with polarization analysis

    Journal of Chemical Physics, Vol. 158, Núm. 18

2021

  1. A Cost-Effective Semi-Ab Initio Approach to Model Relaxation in Rare-Earth Single-Molecule Magnets

    Journal of Physical Chemistry Letters, Vol. 12, Núm. 36, pp. 8826-8832

2020

  1. Coherent structural relaxation of water from meso- To intermolecular scales measured using neutron spectroscopy with polarization analysis

    Physical Review Research, Vol. 2, Núm. 2

  2. Understanding magnetic relaxation in single-ion magnets with high blocking temperature

    Physical Review B, Vol. 101, Núm. 17

2018

  1. The performance of density functional theory for the description of ground and excited state properties of inorganic and organometallic uranium compounds

    Journal of Organometallic Chemistry, Vol. 857, pp. 58-74

2016

  1. Dynamics and Structure of Poly(ethylene oxide) Intercalated in the Nanopores of Resorcinol-Formaldehyde Resin Nanoparticles

    Macromolecules, Vol. 49, Núm. 15, pp. 5704-5713

  2. Generation and Evolution of Spin-, Valley-, and Layer-Polarized Excited Carriers in Inversion-Symmetric WSe2

    Physical Review Letters, Vol. 117, Núm. 27

2015

  1. Influence of Solvent on Poly(2-(Dimethylamino)Ethyl Methacrylate) Dynamics in Polymer-Concentrated Mixtures: A Combined Neutron Scattering, Dielectric Spectroscopy, and Calorimetric Study

    Macromolecules, Vol. 48, Núm. 18, pp. 6724-6735

2014

  1. Intercalation and confinement of poly(ethylene oxide) in porous carbon nanoparticles with controlled morphologies

    Macromolecules, Vol. 47, Núm. 24, pp. 8729-8737

  2. Investigation of a nanocomposite of 75 wt % poly(methyl methacrylate) nanoparticles with 25 wt % poly(ethylene oxide) linear chains: A quasielatic neutron scattering, calorimetric, and waxs study

    Macromolecules, Vol. 47, Núm. 9, pp. 3005-3016

  3. Microscopic dynamics in nanocomposites of poly(ethylene oxide) and poly(methyl methacrylate) soft nanoparticles: A quasi-elastic neutron scattering study

    Macromolecules, Vol. 47, Núm. 1, pp. 304-315

  4. Neutron spectroscopy as a probe of macromolecular structure and dynamics under extreme spatial confinement

    Journal of Physics: Conference Series

2013

  1. Confinement of poly(ethylene oxide) in the nanometer-scale pores of resins and carbon nanoparticles

    Soft Matter, Vol. 9, Núm. 46, pp. 10960-10965

2012

  1. Macromolecular structure and vibrational dynamics of confined poly(ethylene oxide): From subnanometer 2d-intercalation into graphite oxide to surface adsorption onto graphene sheets

    ACS Macro Letters, Vol. 1, Núm. 5, pp. 550-554

  2. Tunable uptake of poly(ethylene oxide) by graphite-oxide-based materials

    Carbon, Vol. 50, Núm. 14, pp. 5232-5241

  3. Two-dimensional subnanometer confinement of ethylene glycol and Poly(ethylene oxide) by neutron spectroscopy: Molecular size effects

    Macromolecules, Vol. 45, Núm. 7, pp. 3137-3144

2011

  1. Polymers under extreme two-dimensional confinement: Poly(ethylene oxide) in graphite oxide

    Soft Matter, Vol. 7, Núm. 16, pp. 7173-7176

2010

  1. Size consistency of explicit functionals of the natural orbitals in reduced density matrix functional theory

    Journal of Chemical Physics, Vol. 132, Núm. 8