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Annual Reports in Computational Chemistry
Timely and critical reviews of important topics in computational chemistry
David A. Dixon (Series edited by)
9780444637109, Elsevier Science
Hardback, published 25 November 2015
436 pages
22.9 x 15.1 x 2.8 cm, 0.58 kg
Annual Reports in Computational Chemistry provides timely and critical reviews of important topics in computational chemistry as applied to all chemical disciplines. Topics covered include quantum chemistry, molecular mechanics, force fields, chemical education, and applications in academic and industrial settings. Focusing on the most recent literature and advances in the field, each article covers a specific topic of importance to computational chemists.
Quantum Chemistry (Section A)
- NMR Calculations for Paramagnetic Molecules and Metal Complexes
- The Nonlocal Correlation Density Functional VV10: a Successful Attempt to Accurately Capture Noncovalent Interactions
- Modeling Laser Induced Molecule Excitations Using Real-Time Time-Dependent Density Functional Theory
- Chemical Bonding, Reactivity and Viability of Large Boron Clusters
- A Computational Perspective on Multichannel Scattering Theory with Applications to Physical and Nuclear Chemistry
- Intermolecular Network Theory: A General Approach for Understanding the Structural and Dynamic Properties of Liquids and Solutions Aurora E. Clark
Jochen Autschbach
Joaquín Calbo, Enrique Ortí, Juan C. Sancho-García and Juan Aragó
Attila Bende
Jules Tshishimbi Muya, Minh Tho Nguyen and Arnout Ceulemans
Scattering Theory (Section B)
Simone Taioli and Stefano Simonucci
Theory of Liquids (Section C)
Subject Areas: Enterprise software [UFL], Analytical chemistry [PNF]
