A unique combination of imaging tools and atomic-level simulations allowed the team to solve a longstanding debate about the properties of a promising material that can harvest energy from light.
Understanding the 3-D distribution and nature of active sites in heterogeneous catalysts is critical to developing useful structure−function relationships but it is very difficult to achieve such 3-D information.
A general approach for quantitatively investigating the spatiotemporal dependence of structural relaxation in deformed polymers based on using small-angle neutron scattering alongside HPC-enabled nonequilibrium molecular dynamics simulations was develop
