Titlebook: Scientific Computing and Algorithms in Industrial Simulations; Projects and Product Michael Griebel,Anton Schüller,Marc Alexander Schw Book

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chemoprevention

LC-GAP: Localized Coulomb Descriptors for the Gaussian Approximation Potentialan approximation potential approach, we present LC-GAP, a new system for generating atomic potentials through machine learning (ML). Tests on the QM7, QM7b and GDB9 biomolecular datasets demonstrate that potentials created with LC-GAP can successfully predict atomization energies for molecules large

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notion

Cooling Circuit Simulation I: Modelingh circuits are pipes, regulated pumps, regulated (multi-way) valves, and energy exchangers. For these elements, we give an overview of the modeling process including the basics of the continuum mechanics of fluids, together with simplifying assumptions that are practically acceptable. Moreover, we c

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Algebraic Multigrid: From Academia to Industryions. In spite of this, it took nearly three decades for it to be seriously recognized and used outside the research community. Surprisingly, not the original . (GMG) but . (AMG) finally brought the breakthrough. When SCAI (Fraunhofer Institute for Algorithms and Scientific Computing)—formerly an in

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Parallel Algebraic Multigridthis paper we focus on the parallelization of algebraic multigrid (AMG) in general and identify the respective challenges imposed on any hierarchical iterative linear solver. Moreover, we summarize the strategies employed in the parallel implementation of our SAMG library to cope with these issues a

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