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Calculation of partition functions of tetra-atomic molecules

✍ Scribed by Jelena Radić-Perić


Book ID
105102894
Publisher
Springer
Year
1991
Tongue
English
Weight
709 KB
Volume
8
Category
Article
ISSN
0259-9791

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Atoms-in-molecules partitioning of a mol
✍ Andrés Cedillo; Pratim K. Chattaraj; Robert G. Parr 📂 Article 📅 2000 🏛 John Wiley and Sons 🌐 English ⚖ 335 KB 👁 1 views

An atoms-in-a-molecule partitioning procedure, based on the minimization of the molecular grand potential, is presented. The fragments in the molecule are obtained from a set of integral operators that project the total density into its components, with the sum of the fragment densities equal to the