Practical Aspects of Computational Chemistry I: An Overview of the Last Two Decades and Current Trends (Paperback)
  • Practical Aspects of Computational Chemistry I: An Overview of the Last Two Decades and Current Trends (Paperback)
zoom

Practical Aspects of Computational Chemistry I: An Overview of the Last Two Decades and Current Trends (Paperback)

(editor), (editor)
£149.99
Paperback 680 Pages / Published: 24/02/2014
  • We can order this

Usually dispatched within 3 weeks

  • This item has been added to your basket

Practical Aspects of Computational Chemistry I: An Overview of the Last Two Decades and Current Trends gathers the advances made within the last 20 years by well-known experts in the area of theoretical and computational chemistry and physics. The title itself reflects the celebration of the twentieth anniversary of the "Conference on Current Trends in Computational Chemistry (CCTCC)" to which all authors have participated and contributed to its success.

This volume poses (and answers) important questions of interest to the computational chemistry community and beyond. What is the historical background of the "Structural Chemistry"? Is there any way to avoid the problem of intruder state in the multi-reference formulation? What is the recent progress on multi-reference coupled cluster theory? Starting with a historical account of structural chemistry, the book focuses on the recent advances made in promising theories such as many body Brillouin-Wigner theory, multireference state-specific coupled cluster theory, relativistic effect in chemistry, linear and nonlinear optical properties of molecules, solution to Kohn-Sham problem, electronic structure of solid state materials, development of model core potential, quantum Monte Carlo method, nano and molecular electronics, dynamics of photodimerization and excited states, intermolecular interactions, hydrogen bonding and non-hydrogen bonding interactions, conformational flexibility, metal cations in zeolite catalyst and interaction of nucleic acid bases with minerals.

Practical Aspects of Computational Chemistry I: An Overview of the Last Two Decades and Current Trends is aimed at theoretical and computational chemists, physical chemists, materials scientists, and particularly those who are eager to apply computational chemistry methods to problem of chemical and physical importance. This book will provide valuable information to undergraduate, graduate, and PhD students as well as to established researchers.

Publisher: Springer
ISBN: 9789400797710
Number of pages: 680
Weight: 1050 g
Dimensions: 235 x 155 x 38 mm
Edition: 2012 ed.

You may also be interested in...

Molecular Symmetry and Group Theory
Added to basket
Early Responses to the Periodic System
Added to basket
Renormalization Methods
Added to basket
NMR: The Toolkit
Added to basket
£19.99
Paperback
Molecular Quantum Mechanics
Added to basket
Foundations of Physics for Chemists
Added to basket
Why Chemical Reactions Happen
Added to basket
Note-by-Note Cooking
Added to basket
£20.00
Hardback
Napoleon'S Buttons
Added to basket
Atkins' Physical Chemistry
Added to basket
Reactions
Added to basket
£12.99
Paperback
An Introduction to Fire Dynamics
Added to basket

Reviews

Please sign in to write a review

Your review has been submitted successfully.