## Quantum-Mechanical Ab-initio Calculation of the Properties of Crystalline MaterialsA number of general-purpose, reasonably accurate and well-tested ab-initio codes for crystals are discussed in this book. The aim is to expand competence of their application in material sciences and solid-state physics. The book addresses particularly readers with a general knowledge in quantum chemistry and intends to give a deeper insight into the special algorithms and computational techniques in ab-initio computer codes for crystals. Three different programs which are available to all interested potential users on request are presented. |

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### References to this book

Mathematical Models and Methods for Ab Initio Quantum Chemistry M. Defranceschi,C. Le Bris Limited preview - 2000 |

Metal-Ligand Interactions in Chemistry, Physics and Biology N. Russo,Dennis R. Salahub Limited preview - 2000 |