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Topological Analysis of Functions on Arbitrary Grids: Applications to Quantum Chemistry
[Image: see text] Algorithms are presented for performing a topological analysis of an arbitrary function, evaluated on an arbitrary grid of points. These algorithms work strictly by post-processing the data and require no additional function evaluations. This is achieved by connecting the grid poin...
| Autores principales: | , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
American Chemical Society
2022
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9558314/ https://www.ncbi.nlm.nih.gov/pubmed/36070593 http://dx.doi.org/10.1021/acs.jctc.2c00649 |