Ab-initio Assisted Petrology
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Product details:
- Publisher Springer Nature Switzerland
- Date of Publication 22 May 2026
- ISBN 9783032256577
- Binding Hardback
- No. of pages202 pages
- Size 235x155 mm
- Language English
- Illustrations XIII, 202 p. 127 illus., 98 illus. in color. 700
Categories
Long description:
"
This book provides a promotional exercise to foster the application of quantum mechanics to petrology. It addresses long-standing discrepancies in high-pressure melting data and provides a full appraisal of anharmonicity, essential for computing heat capacities, Gibbs free energy, and energy landscapes. Unlike empirical models, quantum-mechanical simulations deliver first-principles accuracy for complex systems, from pure oxides to quaternary compositions, using advanced mathematical tools like Delaunay Fragmentation and Convex Hull Analysis.
" MoreTable of Contents:
Premises.- Simplicial complexes, convex hulls and Delaunay triangulations.- Liquidus derivation and analysis.- Thermodynamic and Thermophysical assessment.- End member components.- Binary Joins.- The thernaries.- The CaO-MgO-Al2O3-SiO2 quaternary system.
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