Quantum-Mechanical Ab-initio Calculation of the Properties of Crystalline Materials (Lecture Notes in Chemistry)

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9783540616450: Quantum-Mechanical Ab-initio Calculation of the Properties of Crystalline Materials (Lecture Notes in Chemistry)

A 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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Book Description Springer-Verlag Berlin and Heidelberg GmbH Co. KG, Germany, 1996. Paperback. Book Condition: New. 1996 ed.. 231 x 155 mm. Language: English . Brand New Book ***** Print on Demand *****.A 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. Bookseller Inventory # AAV9783540616450

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