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portada Fragmentation: Toward Accurate Calculations on Complex Molecular Systems (in English)
Type
Physical Book
Publisher
Language
Inglés
Pages
376
Format
Hardcover
Dimensions
24.6 x 17.5 x 2.3 cm
Weight
0.86 kg.
ISBN13
9781119129240

Fragmentation: Toward Accurate Calculations on Complex Molecular Systems (in English)

Gordon, Mark S. (Author) · Wiley · Hardcover

Fragmentation: Toward Accurate Calculations on Complex Molecular Systems (in English) - Gordon, Mark S.

Physical Book

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  • Condition: New
Origin: United Kingdom (Import costs included in the price)
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Synopsis "Fragmentation: Toward Accurate Calculations on Complex Molecular Systems (in English)"

Fragmentation: Toward Accurate Calculations on Complex Molecular Systems introduces the reader to the broad array of fragmentation and embedding methods that are currently available or under development to facilitate accurate calculations on large, complex systems such as proteins, polymers, liquids and nanoparticles. These methods work by subdividing a system into subunits, called fragments or subsystems or domains. Calculations are performed on each fragment and then the results are combined to predict properties for the whole system. Topics covered include: Fragmentation methods Embedding methods Explicitly correlated local electron correlation methods Fragment molecular orbital method Methods for treating large molecules This book is aimed at academic researchers who are interested in computational chemistry, computational biology, computational materials science and related fields, as well as graduate students in these fields.

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All books in our catalog are Original.
The book is written in English.
The binding of this edition is Hardcover.

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