JCP Communication on Conical Intersections at Semiconductor Defects

Check out Yinan’s communication in J. Chem. Phys. demonstrating that conical intersections in models of defects at the silicon-silicon oxide interface facilitate ultrafast non-radiative decay.  Decay via such conical intersections may play a role in determining the photoluminescence spectrum of oxidized silicon nanoparticles.

Also, don’t forget to take a look at his recent J. Chem. Phys. article on preventing symmetry breaking in multireference wavefunctions.

GPU Cluster

Our computer cluster, dodec, has just grown to include eight new machines, each with four NVidia Kepler GPUs, 96 GB of RAM, and 12 Intel Xeon cores.  Many thanks to Paul Reed for getting it up and running!

Welcome Monica O’Brien

Welcome to Monica O’Brien, an undergraduate who will be working with us this summer.  Monica will be studying multiple excitations in models of semiconducting polymers.

Welcome Scott Fales

I’m very happy to welcome Bryan (Scott) Fales to our group!  Scott will be working on GPU acceleration of electronic structure simulations.

Hello MSU!

Prof. Levine is very excited to have joined the faculty of the MSU Chemistry Department.  Let the science begin!

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