Thursday, September 14, 2017

In a recent issue of Physical Review Letters, former Burke group graduate students Zenghui Yang (chem PhD 2011) and Aurora Pribram-Jones (chem PhD 2015), along with Profs Ullrich (U. Missouri) and Burke, show how to extract electronic double excitations from density functional theory without using TDDFT.  The figure shows their approximation for the Be atom.  For more, click here.