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ISSN Печать: 1543-1649
ISSN Онлайн: 1940-4352
Indexed in
Coupling Methods for Continuum Model with Molecular Model
Краткое описание
This article develops coupling methods for continuum models with molecular models. Two methods are studied here: an overlapping domain decomposition method, which has overlapping domain; and an edge-to-edge decomposition method, which has an interface between the two models. These two methods enforce compatibility on the overlapping domain or interface nodes/atoms by the Lagrange multiplier method or the augmented Lagrangian method.
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