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Supercomputer Algorithms for Reactivity, Dynamics and Kinetics of Small Molecules
Antonio . Ed(S): Lagana
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Description for Supercomputer Algorithms for Reactivity, Dynamics and Kinetics of Small Molecules
Paperback. Proceedings of the NATO Advanced Research Workshop, Colombella di Perugia, Italy, August 30-September 3, 1988 Editor(s): Lagana, Antonio. Series: NATO Science Series C. Num Pages: 458 pages, biography. BIC Classification: PHU; PNR; WM. Category: (P) Professional & Vocational. Dimension: 244 x 170 x 23. Weight in Grams: 780.
The need for accurate computational procedures to evaluate detailed properties of gas phase chemical reactions is evident when one considers the wealth of information provided by laser, molecular beam and fast How experiments. By stressing ordinary scalar computers to their limiting performance quantum chemistry codes can already provide sufficiently accurate estimates of the stability of several small molecules and of the reactivity of a few elementary processes. However, the accurate characterization of a reactive process, even for small systems, is so demanding in terms of computer resources to make the use of supercomputers having vector and parallel features unavoidable. Sometimes ... Read more
The need for accurate computational procedures to evaluate detailed properties of gas phase chemical reactions is evident when one considers the wealth of information provided by laser, molecular beam and fast How experiments. By stressing ordinary scalar computers to their limiting performance quantum chemistry codes can already provide sufficiently accurate estimates of the stability of several small molecules and of the reactivity of a few elementary processes. However, the accurate characterization of a reactive process, even for small systems, is so demanding in terms of computer resources to make the use of supercomputers having vector and parallel features unavoidable. Sometimes ... Read more
Product Details
Format
Paperback
Publication date
2011
Publisher
Springer Netherlands
Number of pages
458
Condition
New
Series
NATO Science Series C
Number of Pages
452
Place of Publication
Dordrecht, Netherlands
ISBN
9789401069151
SKU
V9789401069151
Shipping Time
Usually ships in 15 to 20 working days
Ref
99-15
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