Molecular dynamics at constant temperature and pressure
Molecular dynamics is a technique in which the trajectories of a group of particles are calculated as a function of time by integrating the equations of motion. In this thesis we study the use of molecular dynamics for atoms in a crystal. A model is introduced which describes interactions of a physi...
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| Language: | en_US |
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2012
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| Online Access: | http://hdl.handle.net/1957/34907 |