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2015 | 128 | 4 | 637-639
Article title

Molecular Dynamics Simulations of Poly(dimethylsiloxane) Properties

Content
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Languages of publication
EN
Abstracts
EN
Models of poly(dimethylsiloxane) (PDMS) oligomers differing in topology are defined and structure and mechanical properties of these analysed by three different theoretical approaches: the Bicerano graph method, atomistic molecular dynamics simulations and mesoscale dissipative particle dynamics. The calculations are performed within the simulation software environment Materials Studio (Accelrys Software Inc.). The obtained values of the Young and bulk modulus are juxtaposed to experimental data available for real PDMS materials and quality of the agreement discussed in relation to the theory level and simulation method applied.
Keywords
EN
Year
Volume
128
Issue
4
Pages
637-639
Physical description
Dates
published
2015-10
References
  • [1] J.C. Lottersy, W. Olthuis, P.H. Veltink, P. Bergveld, J. Micromech. Microeng. 7, 145 (1997), doi: 10.1088/0960-1317/7/3/017
  • [2] Ch. Lu, W. Sun, S.J. Harley, E. Glascoe, in: Proc. TOUGH Symp. 2012, California, 2012
  • [3] F. Ay, A. Kocabas, C. Kocabas, A. Aydinli, J. Appl. Phys. 96, 7147 (2004), doi: 10.1063/1.1812823
  • [4] Yan Ji, Yan Y. Huang, Rakchanok Rungsawang, E.M. Terentjev, Adv. Mater. 22, 3436 (2010), doi: 10.1002/adma.200904103
  • [5] J. Fojtikova, M.Sc. Thesis, FNSPE CTU in Prague, Prague 2013
  • [6] P. Levinský, L. Kalvoda, J. Aubrecht, J. Fojtíková, Proc. SPIE 9450, 94500D (2015), doi: 10.1117/12.2070372
  • [7] BIOVIA Materials Studio http://accelrys.com/products/materials-studio/
  • [8] J. Bicerano, Prediction of Polymer Properties, 3rd ed., Marcel Dekker, New York 2002
  • [9] A.C.C. Esteves, J. Brokken-Zijp, J. Lavena, H.P. Huinink, N.J.W. Reuvers, M.P. Van, G. de With, Polymer 50, 3955 (2009), doi: 10.1016/j.polymer.2009.06.022
  • [10] M. Meunier, J. Chem. Phys. 123, 134906 (2005), doi: 10.1063/1.2049274
  • [11] G. Fitzgerald, G. Goldbeck-Wood, P. Kung, M. Petersen, L. Subramanian, J. Wescott, Comput. Model. Eng. Sci. 24, 169 (2008), doi: 10.3970/cmes.2008.024.169
  • [12] I.D. Johnston, D.K. McCluskey, C.K.L. Tan, M.C. Tracey, J. Micromech. Microeng. 24, 035017 (2014), doi: 10.1088/0960-1317/24/3/035017
Document Type
Publication order reference
YADDA identifier
bwmeta1.element.bwnjournal-article-appv128n440kz
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