selected publications

• article

  • Relation between structural patterns and magnetism in small iron oxide clusters: Reentrance of the magnetic moment at high oxidation ratios.  Physical Chemistry Chemical Physics.  23:246-272. 2021-01-01
  • Tuning the magnetic moment of small late 3d-transition-metal oxide clusters by selectively mixing the transition-metal constituents.  Nanomaterials.  10:1-22. 2020-01-01
  • Breakdown of magnetism in sub-nanometric Ni clusters embedded in Ag.  Nanotechnology.  26:-. 2015-01-01
  • Structural, vibrational, and magnetic properties of FeCoOn0/%2b (n = 1-6) bimetallic oxide clusters.  Journal of Physical Chemistry C.  119:11200-11209. 2015-01-01
  • Titanium embedded cage structure formation in AlnTi%2b clusters and their interaction with Ar.  Journal of Chemical Physics.  140:-. 2014-01-01
  • Structural, electronic, and magnetic properties of Co nCu m nanoalloys (m %2b n = 12) from first principles calculations.  Journal of Physical Chemistry A.  116:9353-9360. 2012-01-01
  • Ab initio study of the adsorption of NO on the Rh 6 %2b cluster.  Journal of Physical Chemistry A.  115:8350-8360. 2011-01-01