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Tree-Code Based Improvement of Computational Performance of the X-ray-Matter-Interaction Simulation Tool XMDYN
In this work, we report on incorporating for the first time tree-algorithm based solvers into the molecular dynamics code, XMDYN. XMDYN was developed to describe the interaction of ultrafast X-ray pulses with atomic assemblies. It is also a part of the simulation platform, SIMEX, developed for compu...
Autores principales: | Stransky, Michal, Jurek, Zoltan, Santra, Robin, Mancuso, Adrian P., Ziaja, Beata |
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Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
MDPI
2022
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Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9267930/ https://www.ncbi.nlm.nih.gov/pubmed/35807452 http://dx.doi.org/10.3390/molecules27134206 |
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