Published February 27, 2023
| Version Version 1.0
Dataset
Open
Polymorphism and Perfection in Crystallization of Hard Sphere Polymers
- 1. ISOM & ETSII, UPM
Description
Data archive corresponding to the publications "Polymorphism and Perfection in Crystallization of Hard Sphere Polymers" by M. Herranz et al., Polymers 14, 4435 (2022); DOI: https://doi.org/10.3390/polym14204435
Please see README.txt for instructions on how to access and read the files from the crystallographic analysis based on the CCE norm descriptor.
All snapshots have been generated and successively analyzed by the Simu-D software.
Notes
This research was funded by MICINN/FEDER (Ministerio de Ciencia, Innovación y Universidades, Fondo Europeo de Desarrollo Regional), grant numbers "RTI2018-097338-B-I00" and "PID2021-127533NB-I00" and by UPM and Santander Bank, "Programa Propio UPM Santander".
Files
CCE_data.zip
Files
(239.7 MB)
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md5:33f81d7a6ca0762e1886f2a9672ae79c
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239.7 MB | Preview Download |
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md5:a519113001858f70b7c9699d79b5c9be
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1.6 kB | Preview Download |
Additional details
Related works
- Compiles
- Journal article: 10.3390/polym14204435 (DOI)
- Is described by
- Journal article: 10.3390/ijms222212464 (DOI)
- Journal article: 10.3390/cryst10111008 (DOI)
References
- Ramos, P.M.; Herranz, M.; Foteinopoulou, K.; Karayiannis, N.C.; Laso, M. Identification of Local Structure in 2-D and 3-D Atomic Systems through Crystallographic Analysis. Crystals 2020, 10, 1008. https://doi.org/10.3390/cryst10111008
- Herranz, M.; Martínez-Fernández, D.; Ramos, P.M.; Foteinopoulou, K.; Karayiannis, N.C.; Laso, M. Simu-D: A Simulator-Descriptor Suite for Polymer-Based Systems under Extreme Conditions. Int. J. Mol. Sci. 2021, 22, 12464. https://doi.org/10.3390/ijms222212464
- Herranz, M.; Foteinopoulou, K.; Karayiannis, N.C.; Laso, M. Polymorphism and Perfection in Crystallization of Hard Sphere Polymers. Polymers 2022, 14, 4435. https://doi.org/10.3390/polym14204435