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Atomic structures and energies of grain boundaries in Mg2SiO4forsterite from atomistic modeling

โœ Scribed by Omar Adjaoud, Katharina Marquardt, Sandro Jahn

Book ID
118781447
Publisher
Springer-Verlag
Year
2012
Tongue
English
Weight
1001 KB
Volume
39
Category
Article
ISSN
0342-1791

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The method of crystal static deformation, including inner strain effects, was applied to calculate the structure configuration and the elastic constants of forsterite under anisotropic and isotropic pressure. A Born type interatomic potential is used, with optimized atomic charges and repulsive radi