APS March Meeting 2012
Volume 57, Number 1
Monday–Friday, February 27–March 2 2012;
Boston, Massachusetts
Session A7: Focus Session: Computational Design of Materials - Structure Prediction
8:00 AM–11:00 AM,
Monday, February 27, 2012
Room: 207
Sponsoring
Units:
DMP DCOMP
Chair: Richard Hennig, Cornell University
Abstract ID: BAPS.2012.MAR.A7.4
Abstract: A7.00004 : Mapping the Materials Genome through Combinatorial Informatics
8:36 AM–9:12 AM
Preview Abstract
Abstract
Author:
Krishna Rajan
(Iowa State University)
The recently announced White House Materials Genome Initiative provides an
exciting challenge to the materials science community. To meet that
challenge one needs to address a critical question, namely \textit{what} is the materials
genome? Some guide on how to the answer this question can be gained by
recognizing that a ``gene'' is a carrier of information. In the biological
sciences, discovering how to manipulate these genes has generated exciting
discoveries in fundamental molecular biology as well as significant advances
in biotechnology. Scaling that up to molecular, cellular length scales and
beyond, has spawned from genomics, fields such as proteomics, metabolomics
and essentially systems biology. The ``omics'' approach requires that one
needs to discover and track these ``carriers of information'' and then
correlate that information to predict behavior. A similar challenge lies in
materials science, where there is a diverse array of modalities of materials
``discovery'' ranging from new materials chemistries and molecular
arrangements with novel properties, to the development and design of new
micro- and mesoscale structures. Hence to meaningfully adapt the spirit of
``genomics'' style research in materials science, we need to first identify
and map the ``genes'' across different materials science applications On the
experimental side, combinatorial experiments have opened a new approach to
generate data in a high throughput manner, but without a clear way to link
that to models, the full value of that data is not realized. Hence along
with experimental and computational materials science, we need to add a
``third leg'' to our toolkit to make the ``Materials Genome'' a reality, the
science of Materials Informatics. In this presentation we provide an
overview of how information science coupled to materials science can in fact
achieve the goal of mapping the ``Materials Genome''.
To cite this abstract, use the following reference: http://meetings.aps.org/link/BAPS.2012.MAR.A7.4