% IMPORTANT: The following is UTF-8 encoded. This means that in the presence % of non-ASCII characters, it will not work with BibTeX 0.99 or older. % Instead, you should use an up-to-date BibTeX implementation like “bibtex8” or % “biber”. @ARTICLE{Verberck:21148, author = {Verberck, B. and Cambedouzou, J. and Vliegenthart, G.A. and Gompper, G. and Launois, P.}, title = {{M}onte {C}arlo {S}tudies of {C}60 and {C}70-{P}eapods}, journal = {Fullerenes, nanotubes $\&$ carbon nanostructures}, volume = {20}, number = {4-7}, issn = {1536-383X}, address = {London [u.a.]}, publisher = {Taylor $\&$ Francis}, reportid = {PreJuSER-21148}, pages = {371-377}, year = {2012}, note = {Helpful discussions with K. H. Michel, P.-A. Albouy and C. Bousige are gratefully acknowledged. This work was financially supported by the Research Foundation-Flanders (FWO-Vl).}, comment = {.}, booktitle = {.}, abstract = {We present results of Monte Carlo simulations of chains of C-60 and chains of C-70 molecules encapsulated in a single-walled carbon nanotube (SWCNT). We observe the changes in the configuration of the fullerene molecules when varying tube radius and temperature. In particular, the evolution of the pair correlation functions reveal a transition from linear harmonic chain behavior to a hard-sphere liquid upon heating, demonstrating the possibility of tuning properties of C-60- and C-70@SWCNT peapods with radius and temperature.}, keywords = {J (WoSType)}, cin = {ICS-2 / IAS-2}, ddc = {530}, cid = {I:(DE-Juel1)ICS-2-20110106 / I:(DE-Juel1)IAS-2-20090406}, pnm = {BioSoft: Makromolekulare Systeme und biologische Informationsverarbeitung}, pid = {G:(DE-Juel1)FUEK505}, shelfmark = {Chemistry, Physical / Nanoscience $\&$ Nanotechnology / Materials Science, Multidisciplinary / Physics, Atomic, Molecular $\&$ Chemical}, typ = {PUB:(DE-HGF)16}, UT = {WOS:000304297500015}, doi = {10.1080/1536383X.2012.655190}, url = {https://juser.fz-juelich.de/record/21148}, }