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Environment from the Molecular Level
A NERC eScience testbed project |
I am reader in Condensed Matter Simulations at the University of Cambridge. I work in ab initio simulations of condensed matter, with an emphasis in the simulation of natural matter, including minerals, liquids and biomolecules, but also materials and nano-systems, in addition to the development of simulation methods.
Contact details:
Background notes:
I obtained my PhD in Condensed Matter Physics at
the Universidad
Autonoma de Madrid in 1990. I then spent two years at
the
University of California at Berkeley as a
Fulbright fellow, and one year at the
Max-Planck Institute for Solid-State Research, as an
Alexander-von-Humboldt
fellow. In 1993 I became Assistant Professor at
the Universidad Autonoma de Madrid, where I was tenured by the end of 1995.
During my years in Madrid, I spent part of 1999 as Visiting Professor
at the Ecole Normale Superiere de Lyon.
In 2001 I was appointed Lecturer at the Earth Sciences Department
in Cambridge, and became Reader in Condensed Matter Simulations
in October 2002. I am Official Fellow of Clare Hall since March 2002.
I am involved in the development and application
of first-principles methods for the simulation of matter in the solid
and liquid state. In collaboration with the
SIESTA team,
we have implemented our own linear-scaling density-functional
method for the purpose. I have used it for the study of nanostructured
materials (carbon nanotubes, metallic clusters), biomolecules,
and lately to clays and molten silicon. I am intereseted in silica
melts, wet surfaces, and the bio-geo interface in general.
Recent results include:
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