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Partition Spin-Density Functional Theory

By Martín Mosquera

Molecules are made of atoms, yet quantum mechanics, the theory that describes molecules, treats a molecule as a single object. However, when molecules collide at ...

Jonathan's paper on PDFT is #8 most downloaded JCP paper during December 2011.

http://jcp.aip.org/features/most_downloaded?month=12&year=2011