Articles tagged with: Chemistry

[ Dec 16 2013 - 5:39 pm ]

Titan is allowing scientists to simulate proton-coupled electron transfer at a level that was previously impossible.

[ Dec 13 2013 - 8:00 am ]

Using computational molecular dynamics simulations, researchers at ORNL and the University of Tennessee–ORNL Joint Institute for Computational Sciences have discovered a molecular “switch” in a receptor that controls cell behavior.

[ Aug 14 2013 - 5:53 pm ]

Two prominent OLCF users were recently named UT-Battelle Corporate Fellows.

[ Jun 16 2011 - 12:10 pm ]

Discovery boosts supercapacitor energy storage
Flat is in the eye of the beholder.
When you’re talking about nanomaterials, however, that eye is …

[ May 13 2011 - 2:09 pm ]

Chemistry and materials science simulations made possible through Robert Harrison’s INCITE project have generated 70 scientific publications since 2008.

[ Feb 14 2011 - 2:48 pm ]

The publishers of the online supercomputing magazine HPCwire expect great things of ORNL computational chemist Edoardo Aprà in the coming year. Aprà is among 10 individuals included in the magazine’s “People to Watch” list for 2011.