Title of article
A simple quantum mechanical model for deriving the energy function of n-component systems Original Research Article
Author/Authors
Dietmar Dorninger، نويسنده , , Maciej M، نويسنده ,
Issue Information
روزنامه با شماره پیاپی سال 2004
Pages
7
From page
173
To page
179
Abstract
We consider general systems consisting of n components, like chemical compounds of n atoms, ensembles of n molecules or any kind of network comprising n knots on a microscopic (or even macroscopic) level, together with forces centrally binding to components or due to interactions, whose quantities are known. From these quantities, we derive an energy function that represents the energy of the whole ensemble without making use of the Hamiltonian operator.
Keywords
HMO-theory , Concepts of stability , Molecular orbitals , Energy of n-component systems , Stability of chemical compounds
Journal title
Mathematics and Computers in Simulation
Serial Year
2004
Journal title
Mathematics and Computers in Simulation
Record number
854201
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