Physical Theoretical category: 1363 books

Cover of Heterogeneous Catalysis at Nanoscale for Energy Applications
by Franklin (Feng) Tao, William F. Schneider, Prashant V. Kamat
Language: English
Release Date: February 9, 2015

This book presents both the fundamentals concepts and latest achievements of a field that is growing in importance since it represents a possible solution for global energy problems. It focuses on an atomic-level understanding of heterogeneous catalysis involved in important energy conversion processes....
Cover of Design and Applications of Nanomaterials for Sensors
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Language: English
Release Date: July 8, 2014

Design and Applications of Nano materials for Sensors begins with an introductory contribution by the editors that: gives an overview of the present state of computational and theoretical methods for nanotechnology; outlines hot topics in this field and points to expected developments in the near...
Cover of Computational Spectroscopy

Computational Spectroscopy

Methods, Experiments and Applications

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Language: English
Release Date: August 24, 2011

Unique in its comprehensive coverage of not only theoretical methods but also applications in computational spectroscopy, this ready reference and handbook compiles the developments made over the last few years, from single molecule studies to the simulation of clusters and the solid state, from organic...
Cover of Ultrafast Phenomena in Molecular Sciences

Ultrafast Phenomena in Molecular Sciences

Femtosecond Physics and Chemistry

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Language: English
Release Date: October 22, 2013

This book presents the latest developments in Femtosecond Chemistry and Physics for the study of ultrafast photo-induced molecular processes. Molecular systems, from the simplest H2 molecule to polymers or biological macromolecules, constitute central objects of interest for Physics, Chemistry and...
Cover of The Non-Ergodic Nature of Internal Conversion

The Non-Ergodic Nature of Internal Conversion

An Experimental and Theoretical Approach

by Thomas Scheby Kuhlman
Language: English
Release Date: May 23, 2013

This thesis investigates the transitions from one electronically excited state to another. Such processes - the fastest of events in chemistry - can be studied with femtosecond resolution, and Thomas S. Kuhlman approaches the question both with experimental and theoretical methods. His approach...
Cover of Chemical Bonding at Surfaces and Interfaces
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Language: English
Release Date: August 11, 2011

Molecular surface science has made enormous progress in the past 30 years. The development can be characterized by a revolution in fundamental knowledge obtained from simple model systems and by an explosion in the number of experimental techniques. The last 10 years has seen an equally rapid development...
Cover of Thin Liquid Films

Thin Liquid Films

Dewetting and Polymer Flow

by Ralf Blossey
Language: English
Release Date: May 22, 2012

This book is a treatise on the thermodynamic and dynamic properties of thin liquid films at solid surfaces and, in particular, their rupture instabilities. For the quantitative study of these phenomena, polymer thin films (sometimes referred to as “ultrathin”) have proven to be an invaluable experimental...
Cover of A Structural and Vibrational Investigation into Chromylazide, Acetate, Perchlorate, and Thiocyanate Compounds
by Silvia A. Brandán
Language: English
Release Date: October 28, 2012

A Structural and Vibrational Investigation into Chromyl Azide, Acetate, Perchlorate and Thiocyanate Compounds reviews the structural and vibrational properties of chromyl azide, acetate, perchlorate, and thiocyanate from a theoretical point of view by using Density Functional Theory (DFT) methods....
Cover of Chemical Kinetics

Chemical Kinetics

From Molecular Structure to Chemical Reactivity

by Sebastiao Jose Formosinho, Hugh Burrows, Luis G. Arnaut
Language: English
Release Date: December 21, 2006

Chemical Kinetics bridges the gap between beginner and specialist with a path that leads the reader from the phenomenological approach to the rates of chemical reactions to the state-of-the-art calculation of the rate constants of the most prevalent reactions: atom transfers, catalysis, proton transfers,...
Cover of Relativistic Electronic Structure Theory
by Peter Schwerdtfeger
Language: English
Release Date: March 5, 2004

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...
Cover of Theory of Simple Liquids
by Jean-Pierre Hansen, I.R. McDonald
Language: English
Release Date: February 8, 2006

The third edition of Theory of Simple Liquids is an updated, advanced, but self-contained introduction to the principles of liquid-state theory. It presents the modern, molecular theory of the structural, thermodynamic interfacial and dynamical properties of the liquid phase of materials constituted...
Cover of Solvation Effects on Molecules and Biomolecules

Solvation Effects on Molecules and Biomolecules

Computational Methods and Applications

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Language: English
Release Date: July 3, 2010

This volume is an interdisciplinary treatise on the theoretical approach to solvation problems. It describes the essential details of the theoretical methods and places them into the context of modern applications, and hence is of broad interest to theoreticians and experimentalists. The assembly...
Cover of Clusters

Clusters

Structure, Bonding and Reactivity

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Language: English
Release Date: January 31, 2017

The field of atomic clusters continues to attract great interest amongst physicists and chemists alike. This is in part due to their intrinsic properties and potential industrial applications. The first part of Binary Clusters is devoted to recent developments in experimental techniques, the second...
Cover of Theoretical and Computational Inorganic Chemistry
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Language: English
Release Date: November 22, 2010

The Advances in Inorganic Chemistry series present timely and informative summaries of the current progress in a variety of subject areas within inorganic chemistry, ranging from bio-inorganic to solid state studies. This acclaimed serial features reviews written by experts in the field and serves...
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