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In den WarenkorbPF. Zustand: New.
Sprache: Englisch
Verlag: Berlin, Heidelberg, New York : Springer,, 1977
ISBN 10: 3540083448 ISBN 13: 9783540083443
Anbieter: Buch-Galerie Silvia Umla, DE, Deutschland
O.kart. 212 S. , 25 cm Literaturverz. S. 198 - 206 =Auf d. Rücken: Niketi c-Rasmussen.- Foliertes Bibliotheksexemplar. Mehrfach gestempelt. 71183 3540083448 Sprache: Englisch Gewicht in Gramm: 500.
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25 x 17 cm, Broschur. IX, 212 S. Einband berieben und bestoßen. Innen sauber. Sprache: Englisch Gewicht in Gramm: 550.
Sprache: Englisch
Verlag: Springer, Springer Berlin Heidelberg, 1977
ISBN 10: 3540083448 ISBN 13: 9783540083443
Anbieter: AHA-BUCH GmbH, Einbeck, Deutschland
Taschenbuch. Zustand: Neu. Druck auf Anfrage Neuware - Printed after ordering - 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 haye local ainiaa corresponding to the stable equilibrium conforaations of a aolecule in vacuo, Deglecting interaolecular interactions. ~he exact fora of Y is. of course, unknown. We assume that it can be suitably approximated by a sua of different types of energy contri hutions: , = Y ., +, +, ., be. nb e ~he teras represent cODtributions to the total aolecular potential energy , due to bond stretching and coapression teras Vb' valence aDgle bending teras 'e' iDterDal rotational or torsional teras V, DOD-bonded interactions 'nb and electrostatic or Couloab iDter actions 'e. If there are other intraaolecular aechanisas affecting 79 V, sucD as hydrogen bonding, corresponding terms say be added.
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In den WarenkorbPaperback. Zustand: Very Good. Dust Jacket may NOT BE INCLUDED.CDs may be missing. SHIPS FROM MULTIPLE LOCATIONS. book.