6533b82efe1ef96bd129301c

RESEARCH PRODUCT

Computer Simulations of Undercooled Fluids and Glasses

Daniel HerzbachKurt BinderJürgen HorbachMartin H. Müser

subject

chemistry.chemical_compoundMolecular dynamicsMolten siliconMaterials sciencechemistrySodium oxideMonte Carlo methodAluminium oxideThermodynamicsVerlet integration

description

An introduction to the Molecular Dynamics (MD) simulation of chemically realistic models for undercooled fluids and glasses is given, emphasizing silicatic materials such as molten silicon dioxide and its mixtures with sodium oxide and aluminium oxide, and comparing the simulation results to experimental data whenever possible.

https://doi.org/10.1007/978-3-540-47971-0_1