Accuracy and efficiency of atomic basis set methods versus plane wave calculations with ultrasoft pseudopotentials for DNA base molecules.

Peter Pulay Svein Saebo Massimo Malagoli Jon Baker Accuracy and efficiency of atomic basis set methods versus plane wave calculations with ultrasoft pseudopotentials for DNA base molecules. 599-605 2005 26 Journal of Computational Chemistry 6 http://dx.doi.org/10.1002/jcc.20196 db/journals/jcc/jcc26.html#PulaySMB05