Zobrazeno 1 - 10
of 30
pro vyhledávání: '"Juan J. Cerdà"'
Publikováno v:
Macromolecules. 44:1707-1718
Extensive all-atom molecular dynamics simulations have been performed to investigate the effect of surface features on the adsorption of poly(styrenesulfonate) (PSS) oligomers on top of a modified ...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::713ffcf3db2e772034bcc38216914872
https://doi.org/10.1021/ma1026109
https://doi.org/10.1021/ma1026109
Autor:
Christian Holm, Oreste Piro, Pedro A. Sánchez, Tomàs Sintes, Vincent Ballenegger, Juan J. Cerdà
Publikováno v:
Digital.CSIC. Repositorio Institucional del CSIC
instname
instname
The adsorption of stiff magnetic filaments close to an attractive surface is studied thoroughly via extensive Langevin dynamics simulations (LD). Magnetic filaments are represented by a coarse-grained bead-spring model where each bead bears a point d
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::c2ebf6969001ccb012d85cffef7f4b44
https://doi.org/10.1039/c0sm00772b
https://doi.org/10.1039/c0sm00772b
Publikováno v:
Macromolecules. 43:7828-7838
Explicit solvent all-atom molecular dynamics simulations of mixtures of poly(styrenesulfonate)(PSS) and poly(diallyldimethylammonium) (PDADMA) polyelectrolytes at various salt (NaCl) concentrations are performed. We characterize the formed polyelectr
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::a42ada14f74cf1845523f814ef10832c
https://doi.org/10.1021/ma101091k
https://doi.org/10.1021/ma101091k
Publikováno v:
The European Physical Journal Special Topics. 177:129-148
The present article will give a short overview about the sparse attempts to model films made up by alternating layers of polyanions and polycations, called polyelectrolyte multilayers. First, we will review the current theoretical understanding of th
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::2164c43c9f7d4e5c09e10b691bcdaba4
https://doi.org/10.1140/epjst/e2009-01171-x
https://doi.org/10.1140/epjst/e2009-01171-x
Publikováno v:
Molecular Physics. 107:571-590
We present a theoretical model for calculating the structure factor for ferrofluids with strong inter-particle magnetic dipole–dipole interactions, where chain aggregates are known to exist. Our analytical model is based on the minimization of a fr
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::64563d8c6b190c185ab3e4bf548cfcf6
https://doi.org/10.1080/00268970902893149
https://doi.org/10.1080/00268970902893149
Autor:
Juan J. Cerdà, Tomàs Sintes
Publikováno v:
Biophysical Chemistry. 115:277-283
We present the results of extensive off-lattice Monte-Carlo simulations of a stiff polymer chain adsorbing onto a sticky periodic stripe-like pattern of variable width. We have analyzed, in terms of the chain length and rigidity, the adsorption and t
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::f8ed78b856f968bf9c467f4f9f0dcd9c
https://doi.org/10.1016/j.bpc.2004.12.027
https://doi.org/10.1016/j.bpc.2004.12.027
Publikováno v:
Macromolecules. 38:1469-1477
We present results from extensive Monte Carlo simulations of flexible and semiflexible excluded-volume polymer chains confined to impenetrable spherical surfaces. Our results are compared with the ...
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::a59c88b7a094d4f1371a8d8a3b37dfc5
https://doi.org/10.1021/ma048989n
https://doi.org/10.1021/ma048989n
Publikováno v:
Macromolecules. 36:1407-1413
We present the results of extensive three-dimensional off-lattice Monte Carlo simulations of two interacting spherical brushes. We have measured the interacting force in systems where curvature effects are important. Our results support a description
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::e7dd553a8396f8a8c21b25d64877f980
https://doi.org/10.1021/ma0213955
https://doi.org/10.1021/ma0213955
Publikováno v:
Journal of the European Ceramic Society. 23:2737-2740
The interaction between Ni(001) and cubic-ZrO2(001) surfaces is investigated, focusing on the role of the O vacancies that actually exist in the c-ZrO2 phase stabilized at room temperature. Ab-initio calculations of the electronic charge distribution
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::34b2c4c7a521233c29c93b23fbeb45c9
https://doi.org/10.1016/s0955-2219(03)00284-x
https://doi.org/10.1016/s0955-2219(03)00284-x
Publikováno v:
Surface Science. 466:144-154
The electronic structure of the Cu(110)+c(2×2)-Si surface alloy has been studied experimentally by synchrotron radiation photoemission spectroscopy. We have recorded normal emission photoemission spectra as a function of the photon energy, Si covera
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::15f71ad182d81490f5311d7e0ef64de5
https://doi.org/10.1016/s0039-6028(00)00750-0
https://doi.org/10.1016/s0039-6028(00)00750-0