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Relativistic Electronic Structure Theory, Volume 14 - Part 2. Applications (Hardcover): Peter Schwerdtfeger Relativistic Electronic Structure Theory, Volume 14 - Part 2. Applications (Hardcover)
Peter Schwerdtfeger
R8,238 Discovery Miles 82 380 Ships in 12 - 17 working days

The field of relativistic electronic structure theory is generally not part of theoretical chemistry education, and is therefore not covered in most quantum chemistry textbooks. This is due to the fact that only in the last two decades have we learned about the importance of relativistic effects in the chemistry of heavy and superheavy elements. Developments in computer hardware together with sophisticated computer algorithms make it now possible to perform four-component relativistic calculations for larger molecules. Two-component and scalar all-electron relativistic schemes are also becoming part of standard ab-initio and density functional program packages for molecules and the solid state. The second volume of this two-part book series is therefore devoted to applications in this area of quantum chemistry and physics of atoms, molecules and the solid state. Part 1 was devoted to fundamental aspects of relativistic electronic structure theory whereas Part 2 covers more of the applications side. This volume opens with a section on the Chemistry of the Superheavy Elements and contains chapters dealing with Accurate Relativistic Fock-Space Calculations for Many-Electron Atoms, Accurate Relativistic Calculations Including QED, Parity-Violation Effects in Molecules, Accurate Determination of Electric Field Gradients for Heavy Atoms and Molecules, Two-Component Relativistic Effective Core Potential Calculations for Molecules, Relativistic Ab-Initio Model Potential Calculations for Molecules and Embedded Clusters, Relativistic Pseudopotential Calculations for Electronic Excited States, Relativistic Effects on NMR Chemical Shifts, Relativistic Density Functional Calculations on Small Molecules, Quantum Chemistry with the Douglas-Kroll-Hess Approach to Relativistic Density Functional Theory, and Relativistic Solid State Calculations.
- Comprehensive publication which focuses on new developments in relativistic quantum electronic structure theory
- Many leaders from the field of theoretical chemistry have contributed to the TCC series
- Will no doubt become a standard text for scientists in this field.

Dynamic Meteorology - A Basic Course (Paperback): Adrian Gordon, Warwick Grace, Roland Byron-Scott, Peter Schwerdtfeger Dynamic Meteorology - A Basic Course (Paperback)
Adrian Gordon, Warwick Grace, Roland Byron-Scott, Peter Schwerdtfeger
R1,248 Discovery Miles 12 480 Ships in 12 - 17 working days

'Dynamic Meteorology: A Basic Course' is an introduction to the physics of the atmosphere. Starting from the basics, it provides students with an awareness of simple mathematics and enthusiastically proceeds to provide a thorough grounding in the fundamentals of meteorology. The authors lead students to a scientifically rigorous understanding of the behaviour of weather systems such as highs, lows, fronts, jet streams and tropical cyclones. From the 'ABC' of the laws of Avogrado, Boyle and Charles to the powerful omega equation and beyond, this is a simple exposition of dynamic meteorology. Why does the wind blow along the lines of isobars rather than across them? Why are low pressure systems on the weather map more intense than high-pressure systems? Why is there much less constraint on the strength of the wind around a cyclone than an anticyclone? An international team of academic experts in meteorology answer these and many other fundamental questions with simple mathematical equations. Covering both northern and southern hemispheres, 'Dynamic Meteorology' equips students of earth and environmental sciences with proper understanding of the essential mathematics necessary to unlock the mysteries of the natural world.

Relativistic Electronic Structure Theory - Fundamentals, Volume 11 (Hardcover): Peter Schwerdtfeger Relativistic Electronic Structure Theory - Fundamentals, Volume 11 (Hardcover)
Peter Schwerdtfeger
R8,510 Discovery Miles 85 100 Ships in 12 - 17 working days

The first volume of this two part series is concerned with the fundamental aspects of relativistic quantum theory, outlining the enormous progress made in the last twenty years in this field. The aim was to create a book such that researchers who become interested in this exciting new field find it useful as a textbook, and do not have to rely on a rather large number of specialized papers published in this area.
.No title is currently available that deals with new developments in relativistic quantum electronic structure theory
.Interesting and relevant to graduate students in chemistry and physics as well as to all researchers in the field of quantum chemistry
.As treatment of heavy elements becomes more important, there will be a constant demand for this title

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