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Delley, B. (2000) From Molecules to Solids with the DMol3Approach. The Journal of Chemical Physics, 113, 7756-7764.
http://dx.doi.org/10.1063/1.1316015
http://dx.doi.org/10.1002/(SICI)1097-461X(1998)68:2<135::AID-QUA6>3.0.CO;2-W

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