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Global Optimization For Molecular Clusters Using A New Smoothing Approach

✍ Scribed by Chung-Shang Shao; Richard Byrd; Elizabeth Eskow; Robert B. Schnabel


Book ID
110263443
Publisher
Springer US
Year
2000
Tongue
English
Weight
372 KB
Volume
16
Category
Article
ISSN
0925-5001

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A modified genetic algorithm approach has been applied to Ε½ . atomic Ar clusters and molecular water clusters up to H O . Several genetic 2 13 operators are discussed which are suitable for real-valued space-fixed atomic coordinates and Euler angles. The performance of these operators has been syst