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      Atomistic spin model simulations of magnetic nanomaterials

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          Abstract

          Atomistic modelling of magnetic materials provides unprecedented detail about the underlying physical processes that govern their macroscopic properties, and allows the simulation of complex effects such as surface anisotropy, ultrafast laser-induced spin dynamics, exchange bias, and mi- crostructural effects. Here we present the key methods used in atomistic spin models which are then applied to a range of magnetic problems. We detail the parallelisation strategies used which enable the routine simulation of extended systems with full atomistic resolution.

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          Inhomogeneous Electron Gas

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            Iterative minimization techniques forab initiototal-energy calculations: molecular dynamics and conjugate gradients

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              First-principles simulation: ideas, illustrations and the CASTEP code

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                Author and article information

                Journal
                2013-10-23
                2013-12-03
                Article
                10.1088/0953-8984/26/10/103202
                1310.6143

                http://arxiv.org/licenses/nonexclusive-distrib/1.0/

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                cond-mat.mtrl-sci

                Condensed matter

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