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Lattice-dynamical evaluation of thermodynamic properties and atomic displacement parameters for beryl using a transferable empirical force field
Lattice-dynamical thermodynamic properties atomic displacement parameters beryl transferable empirical force field
2012/4/6
Usingempiricalpotentialsderivedfrom?ttingthevibrationalfrequenciesofagroupofsilicatesandoxides,andcrystallographicinformation,aBorn-vonKarmanrigid-ionlattice-
dynamicalmodelhasbeenappliedtothewholeBr...
Lattice-dynamical evaluation of atomic displacement parameters of minerals and its implications: The example of diopside
Lattice-dynamical evaluation atomic displacement parameters minerals diopside
2012/4/6
ABorn-von Karman rigid-ion, lattice-dynamical model has been applied to diopside with the use of empirical potentials derived by fitting the vibrational frequencies of a group ofnesosilicates and oxid...