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Scientists from the Critical Materials Institute used the Titan supercomputer and Eos computing cluster at ORNL to analyze designer molecules that could increase the yield of rare earth elements found in bastnaesite, an important mineral 

After a monolayer MXene is heated, functional groups are removed from both surfaces. Titanium and carbon atoms migrate from one area to both surfaces, creating a pore and forming new structures. Credit: ORNL, USDOE; image by Xiahan Sang and Andy Sproles.

Scientists at the Department of Energy’s Oak Ridge National Laboratory induced a two-dimensional material to cannibalize itself for atomic “building blocks” from which stable structures formed. The findings, reported in Nature Communications, provide insights that ...

Graphical representation of a deuteron, the bound state of a proton (red) and a neutron (blue). Credit: Andy Sproles/Oak Ridge National Laboratory, U.S. Dept. of Energy.

Scientists at the Department of Energy’s Oak Ridge National Laboratory are the first to successfully simulate an atomic nucleus using a quantum computer. The results, published in Physical Review Letters, demonstrate the ability of quantum systems to compute nuclear ph...

Materials—Polymer-theory-problem

Scientists at Oak Ridge National Laboratory have conducted a series of breakthrough experimental and computational studies that cast doubt on a 40-year-old theory describing how polymers in plastic materials behave during processing.