Publicaciones (49) Publicaciones de M. BEGOÑA TORRES CABRERA

2024

  1. Li-decorated BC3 nanopores: Promising materials for hydrogen storage

    International Journal of Hydrogen Energy, Vol. 57, pp. 26-38

2023

  1. Theoretical study of structural, electronic and magnetic properties of Co clusters embedded in an Ag matrix

    Solid State Communications, Vol. 372

  2. Thiosemicarbazonecopper/Halido Systems: Structure and DFT Analysis of the Magnetic Coupling

    Inorganics, Vol. 11, Núm. 1

2021

  1. GCMC Hydrogen Storage on Schwarzites and Slit-shaped Pores at Room Temperature.

    RHEC 2021, 1st Regional Hydrogen Energy Conference

  2. Grand Canonical Monte Carlo Simulations Of Hydrogen Storage On PIM-1, HPB-PIM And PIM-TMN-Trip.

    9th Global Conference
 on Global Warming (GCGW 2021)

  3. Grand Canonical Monte Carlo Simulations Of The Hydrogen Storage On BC3 Slit-Shaped Pores

    9th Global Conference
 on Global Warming (GCGW 2021)

  4. Hydrogen storage capacity of Li-decorated borophene and pristine graphene slit pores: A combined ab initio and quantum-thermodynamic study

    Applied Surface Science, Vol. 562

  5. Relation between structural patterns and magnetism in small iron oxide clusters: Reentrance of the magnetic moment at high oxidation ratios

    Physical Chemistry Chemical Physics, Vol. 23, Núm. 1, pp. 246-272

2020

  1. Tuning the magnetic moment of small late 3d-transition-metal oxide clusters by selectively mixing the transition-metal constituents

    Nanomaterials, Vol. 10, Núm. 9, pp. 1-22

2019

  1. Magnetic Ordering of Three Thiosemicarbazonecopper(II) Complexes

    The 37th International Symposium on Dynamical Properties of Solids

2018

  1. Composites of metal encapsulated silicon super-atoms M@Si16 for hydrogenstorage

    Proceedings del Congreso EHEC-2018

  2. Endohedral metal super-atoms M@Si16 as new functional materials for applications like hydrogen storage

    Proceedings del Congreso CMMSE 2018

  3. Tuning the magnetic moment of late 3d-transition-metal oxide clusters by selective mixing of the constituents

    Proceedings del Congreso CMMSE 2018

2016

  1. Transition-metal oxide clusters:structural and magnetic properties, infrared spectraand perspectives with applications in catalysis

    Proceedings del Congreso CMMSE 2016

2015

  1. Breakdown of magnetism in sub-nanometric Ni clusters embedded in Ag

    Nanotechnology, Vol. 26, Núm. 45

  2. Structural, vibrational, and magnetic properties of FeCoOn0/+ (n = 1-6) bimetallic oxide clusters

    Journal of Physical Chemistry C, Vol. 119, Núm. 20, pp. 11200-11209

2014

  1. La colaboración institucional en el marco de la mejora de la formación docente del profesorado universitario de Castilla y León

    FECIES 2013: X Foro Internacional sobre Evaluación de la Calidad de la Investigación y de la Educación Superior

  2. Titanium embedded cage structure formation in AlnTi+ clusters and their interaction with Ar

    Journal of Chemical Physics, Vol. 140, Núm. 17

2012

  1. Structural, electronic, and magnetic properties of Co nCu m nanoalloys (m + n = 12) from first principles calculations

    Journal of Physical Chemistry A, Vol. 116, Núm. 37, pp. 9353-9360

2011

  1. Ab initio study of the adsorption of NO on the Rh 6 + cluster

    Journal of Physical Chemistry A, Vol. 115, Núm. 30, pp. 8350-8360