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Persistent Homology for The Quantitative Prediction of Fullerene Stability

Persistent homology is a relatively new tool often used for qualitative analysis of intrinsic topological features in images and data originated from scientific and engineering applications. In this paper, we report novel quantitative predictions of the energy and stability of fullerene molecules, t...

Ausführliche Beschreibung

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Bibliographische Detailangaben
Veröffentlicht in:J Comput Chem
Hauptverfasser: Xia, Kelin, Feng, Xin, Tong, Yiying, Wei, Guo Wei
Format: Artigo
Sprache:Inglês
Veröffentlicht: 2014
Schlagworte:
Online Zugang:https://ncbi.nlm.nih.gov/pmc/articles/PMC4324100/
https://ncbi.nlm.nih.gov/pubmed/25523342
https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1002/jcc.23816
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