Annual Reports in Computational Chemistry edito da Elsevier Science & Technology

Annual Reports in Computational Chemistry

Volume 13

EAN:

9780444639400

ISBN:

0444639403

Pagine:
292
Formato:
Hardback
Lingua:
Inglese
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Descrizione Annual Reports in Computational Chemistry

Annual Reports in Computational Chemistry, Volume 13 provides timely and critical reviews of important topics in computational chemistry. Topics in this new release include chapters on the Quantum Chemical Model for Molecular Properties and Processes at the Extreme High Pressure, a section on Interpreting Bonding and Spectra with Correlated, One-Electron Concepts from Electron Propagator Theory, Benchmark databases of intermolecular interaction energies: design, construction, and significance, Gaussian Accelerated Molecular Dynamics: Theory, Implementation and Applications, and Dissociation in Binary Acid/Base Clusters: An Examination of Inconsistencies Introduced into the Many-Body Expansion by Naive Fragmentation Schemes.

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