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The Consistent Force Field: A Documentation
Niketic, Svetozar R.; Rasmussen, K.
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Description for The Consistent Force Field: A Documentation
Paperback. Series: Lecture Notes in Chemistry. Num Pages: 222 pages, biography. BIC Classification: PN. Category: (P) Professional & Vocational. Dimension: 244 x 170 x 12. Weight in Grams: 401.
In this chapter ve shall discuss the calculation of potential energy associated vith molecular conforaations. Raving obtained cartesian atoaic coordinates defining conforaations. and lists of intraao- cular interactions, as described in Chapter 3, ve are ready to calculate a quantity which in the chemical literature is known as the total aolecular potential energy or the conforaational, steric, strain or intraaolecular energy. ~he conformational energy of a aolecule can be expressed as a function , of all internal coordinates and interatoaic distances, or as a function of atoaic positions specified by soae general coordi- Dates. ~he function , is supposed to ... Read more
In this chapter ve shall discuss the calculation of potential energy associated vith molecular conforaations. Raving obtained cartesian atoaic coordinates defining conforaations. and lists of intraao- cular interactions, as described in Chapter 3, ve are ready to calculate a quantity which in the chemical literature is known as the total aolecular potential energy or the conforaational, steric, strain or intraaolecular energy. ~he conformational energy of a aolecule can be expressed as a function , of all internal coordinates and interatoaic distances, or as a function of atoaic positions specified by soae general coordi- Dates. ~he function , is supposed to ... Read more
Product Details
Format
Paperback
Publication date
1977
Publisher
Springer-Verlag Berlin and Heidelberg GmbH & Co. KG Germany
Number of pages
222
Condition
New
Series
Lecture Notes in Chemistry
Number of Pages
212
Place of Publication
Berlin, Germany
ISBN
9783540083443
SKU
V9783540083443
Shipping Time
Usually ships in 15 to 20 working days
Ref
99-15
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