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Publication Date Publication Date
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2009, 1. Aufl., ISBN 9780470373170, xii, 238
Demonstrates how anyone in math, science, and engineering can master DFT calculationsDensity functional theory (DFT... 
Quantum chemistry | Density functionals | Mathematical physics | Condensed Matter | Physics | SCIENCE
Book
2009, ISBN 9780521898638, Volume 9780521898638, x, 567
... and electronic structure theory. This book provides the first coherent presentation of this rapidly growing field, covering a vast range of methods and their applications, from basic theory to advanced methods... 
Molecular dynamics - Computer simulation | Molecular dynamics
Book
2009, IUCr monographs on crystallography, ISBN 9780199558964, Volume 23, xi, 317
This book defines, for the first time, the rules for predicting H-bond energies and geometries from the properties of the interacting molecules. This new... 
Hydrogen bonding
Book
Macromolecular theory and simulations, ISSN 1022-1344, 1994
Journal
2013, ISBN 3527410082, Volume 9783527410088, xiii, 449
Meeting the need for a work that brings together quantum theory and spectroscopy to convey excitation processes to advanced students and specialists wishing to conduct research and understand... 
Molecular spectroscopy | Excited state chemistry | Spectra | Condensed matter | Quantum theory
Book
2009, International series of monographs on physics, ISBN 9780199235346, Volume no. 143, xi, 641
...s. The book presents the derivation of a microscopic theory for amorphous matter, which exhibits the evolution of such complex motions as a new paradigm of strongly... 
Viscosity | Molecular dynamics | Mode-coupling theory | Equations of motion | Complex fluids
Book
2009, ISBN 9783527320189, xxiii, 419
The first book dedicated to this new and powerful computational method begins with a comprehensive description of MCTDH and its theoretical background. There... 
MCTDH | Quantum theory | Computational Chemistry & Molecular Modeling
Book
2007, ISBN 3527307486, xxxviii, 527
.... Clearly structured, the text begins with advances in theory before moving on to theoretical studies of chemical bonding and reactivity... 
Solid state physics | Molecular structure | Atomic structure | Quantum theory
Book
2005, ISBN 3527306900, xvii, 475
Medicine, chemistry, physics and engineering stand poised to benefit within the next few years from the ingenuity of complex biological structures invented and... 
Bioelectronics | Biology | Biotechnology
Book
2006, ISBN 0471409510, x, 705
Butterfly is no ordinary girl. On the day she is born, the jealous Romola casts a wicked spell and little Butterfly grows wings, making her different from all... 
Evolution (Biology) | Population genetics | Life Sciences | Science | Genetics & Genomics
Book
2006, 1. Aufl., ISBN 9780470018514, xiii, 320 p., [4] p. of plates
... scale methods and techniques. The book systematically covers the theory behind multi-particle and nanoscale systems, introduces multiple scale methods, and finally... 
Electronics | Technology | Microelectronics | Nanostructured materials | Nanotechnology
Book
The Journal of chemical physics, ISSN 1089-7690, 02/2007, Volume 126, Issue 8, pp. 084108 - 084108-12
Journal Article