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Modelling of Minerals and Silicated Materials

Language EnglishEnglish
Book Paperback
Book Modelling of Minerals and Silicated Materials P. D'Arco
Libristo code: 05323784
Publishers Springer, March 2013
The modeling of minerals and silicated materials is a. difficult challenge faced by Solid StatePhysi... Full description
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The modeling of minerals and silicated materials is a. difficult challenge faced by Solid StatePhysics, Quantum Chemistry and Molecular Dynamics communities. The difficulty of such a modeling is due to the wide diversity of elements, including heavy atoms,and types of bonding involved in such systems. Moreover, one has to consider infinite systems: either perfect cr- tals or glasses and melts. In the solid state a given chemical composition gives rise to numerous polymorphs, geometricallycloselyrelated. These polymorphs have very similar energies and related thermodynamical pr- erties which explain the complexity of their phase diagrams. The modeling of silicates and minerals covers a wide field of applications ranging from basic research to technology, from Solid State Physics to Earth and Planetary science. The use of modeling techniques yields information of different nature. In the case of chemical studies, we can mention inv- tigations on catalytic processes occurring on surfaces and in zeolite cages. These calculations find possible applications in chemical engineering, in particular in the oil industry.

About the book

Full name Modelling of Minerals and Silicated Materials
Language English
Binding Book - Paperback
Date of issue 2013
Number of pages 341
EAN 9789401737982
ISBN 9401737983
Libristo code 05323784
Publishers Springer
Weight 539
Dimensions 155 x 235 x 20
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