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Small-Angle X-ray Scattering: Characterization of cubic Au nanoparticles using Debye's scattering formula

Autor: Deumer, Jérôme, Pauw, Brian R., Marguet, Sylvie, Skroblin, Dieter, Taché, Olivier, Krumrey, Michael, Gollwitzer, Christian

We propose a versatile software package in the form of a Python extension, named CDEF (Computing Debye's scattering formula for Extraordinary Formfactors), to approximately calculate scattering profiles of arbitrarily shaped nanoparticles for small-a

Externí odkaz: http://arxiv.org/abs/2109.06570

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Akademický článek

Influence of temperature and point defects on the X-ray diffraction pattern of graphite

Autor: Rhiannon Phillips, Kenny Jolley, Ying Zhou, Roger Smith

Publikováno v: Carbon Trends, Vol 5, Iss , Pp 100124- (2021)

The atomic structure of pure and defective graphite has been modelled using classical many body potentials from which simulated powder X-ray Diffraction (XRD) patterns were produced using the Debyer software. The changes in the XRD patterns due to bo

Externí odkaz: https://doaj.org/article/dd310beff9974a7891b6f963cf22dfe3

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Akademický článek

Order-parameter-aided temperature-accelerated sampling for the exploration of crystal polymorphism and solid-liquid phase transitions.

Autor: Tang-Qing Yu, Pei-Yang Chen, Ming Chen, Amit Samanta, Vanden-Eijnden, Eric, Tuckerman, Mark

Publikováno v: Journal of Chemical Physics; 6/7/2014, Vol. 140 Issue 21, p214109-1-214109-13, 13p, 2 Color Photographs, 1 Diagram, 2 Charts, 10 Graphs

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Akademický článek

Iα to Iβ mechano-conversion and amorphization in native cellulose simulated by crystal bending.

Autor: Chen, Pan, Ogawa, Yu, Nishiyama, Yoshiharu, Ismail, Ahmed E., Mazeau, Karim

Publikováno v: Cellulose; Aug2018, Vol. 25 Issue 8, p4345-4355, 11p

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Akademický článek

The structural and organic magnetoresistance response of poly(9-vinyl carbazole) using low applied magnetic fields and magnetic nanoparticle addition.

Autor: Romero, Mariano, Faccio, Ricardo, Tumelero, Milton A., Pasa, André A., Mombrá, Alvaro W.

Publikováno v: Journal of Materials Chemistry C; 4/21/2017, Vol. 5 Issue 15, p3779-3787, 9p

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Conference

Science gateway for distributed multiscale course management in e-Science and e-Learning — Use case for study and investigation of functionalized nanomaterials.

Autor: Gordienko, Yu., Stirenko, S., Gatsenko, O., Bekenov, L.

Publikováno v: 2015 38th International Convention on Information & Communication Technology, Electronics & Microelectronics (MIPRO); 2015, p178-183, 6p

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