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Computational chemistry is a diverse field, with applications ranging
from biochemistry and nanotechnology to waste remediation and energy
efficiency. Simulation of chemical phenomena has become an
indispensible part of modern chemical research with particular help
from the rapid advance of high performance computing. The CCS
Chemistry research community, currently small and loosely knit, uses
the leading-edge resources of the Center to advance the state of the
art in high-performance computational chemistry through their
individual research programs, including method and algorithm
development and chemical applications. Some activities in
computational chemistry may also be of interest to the Biology and
Materials communities.
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