Parallel DFT gradients using the Fourier Transform Coulomb method.

Jon Baker Krzysztof Wolinski Peter Pulay Parallel DFT gradients using the Fourier Transform Coulomb method. 2581-2588 2007 28 Journal of Computational Chemistry 16 http://dx.doi.org/10.1002/jcc.20765 db/journals/jcc/jcc28.html#BakerWP07