Big Chemical Encyclopedia

Chemical substances, components, reactions, process design ...

Articles Figures Tables About

Local Bond Average

The LBA approach [30] is substantially the same to the volume partitioning approximation implemented by Delph and co-workers [31, 32] who have opened a way in improving the calcidation of local quantities. The volume averaging [Pg.213]


Core-shell configuration and the local bond average (LBA) are necessary to overcome limitations faced by classical continuum or quantum methods in dealing with the strongly localized nature of undercoordinated atoms. [Pg.203]

C.Q. Sun, Thermo-mechanical behavior of low-dimensional systems the local bond average approach. Prog. Mater Sci. 54(2), 179-307 (2009)... [Pg.222]

G. Ouyang, C.Q. Sun, W.G. Zhu, Pressure-stiffened Raman phonons in group III nitrides A local bond average approach. J. Phys. Chem. B 112(16), 5027-5031 (2008)... [Pg.465]


See other pages where Local Bond Average is mentioned: [Pg.213]    [Pg.213]    [Pg.436]    [Pg.439]    [Pg.465]    [Pg.564]    [Pg.564]    [Pg.689]    [Pg.711]    [Pg.728]    [Pg.807]    [Pg.816]    [Pg.835]    [Pg.120]   


SEARCH



Bond localization

Bonding localized

Local bond

Localized bonded

Localized bonds

© 2024 chempedia.info