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split interstitial H1a in diamond

✍ Scribed by Liggins, S.; Newton, M. E.; Goss, J. P.; Briddon, P. R.; Fisher, D.


Book ID
120224146
Publisher
The American Physical Society
Year
2010
Tongue
English
Weight
503 KB
Volume
81
Category
Article
ISSN
1098-0121

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## Abstract Molecular mechanics (MM) is a computer program used in organic chemistry to model the interactions of atoms in a molecule and thereby determine its configuration. The program models the interactions between atoms using two‐body potentials, bond‐bending and bond‐twisting force constants,