Zobrazeno 1 - 10
of 103
pro vyhledávání: '"Kostas Ch. Daoulas"'
Publikováno v:
ACS Macro Letters
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::f214ff6fba6fde0e23179b5eb3295ca3
https://hdl.handle.net/21.11116/0000-000C-960A-021.11116/0000-000C-B9AD-1
https://hdl.handle.net/21.11116/0000-000C-960A-021.11116/0000-000C-B9AD-1
Publikováno v:
The Journal of Physical Chemistry B
Board-shaped polymers form sanidic mesophases: assemblies of parallel lamellae of stacked polymer backbones separated by disordered side chains. Sanidics vary significantly with respect to polymer order inside their lamellae, making them "stepping st
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::04cde3f992d75a94f9380ebdbef885da
https://hdl.handle.net/21.11116/0000-000A-3A39-621.11116/0000-000A-3A3B-4
https://hdl.handle.net/21.11116/0000-000A-3A39-621.11116/0000-000A-3A3B-4
Autor:
Raffaello Potestio, Kostas Ch. Daoulas, Peter Virnau, Burkhard Dünweg, Kurt Kremer, Luca Tubiana, Hideki Kobayashi
Publikováno v:
Journal of Physics: Condensed Matter
Recent theoretical studies have demonstrated that the behaviour of molecular knots is a sensitive indicator of polymer structure. Here, we use knots to verify the ability of two state-of-the-art algorithms—configuration assembly and hierarchical ba
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::155fc05ece520f73834c752e2848e895
Publikováno v:
Journal of Physics: Condensed Matter
We propose a dynamic coarse-graining (CG) scheme for mapping heterogeneous polymer fluids onto extremely CG models in a dynamically consistent manner. The idea is to use as target function for the mapping a wave-vector dependent mobility function der
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::361691d56675e431abf1cd609f91e75f
https://pubmed.ncbi.nlm.nih.gov/33690176
https://pubmed.ncbi.nlm.nih.gov/33690176
Publikováno v:
Soft matter. 2(7)
Recent work exploring phase separation and self-assembly in multicomponent polymer fluids using a particle-based self-consistent field simulation method is reviewed. The computational method is placed in the context of classical molecular dynamics an
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::fce943d19df148a9fdf83278a1f99ec8
https://pubmed.ncbi.nlm.nih.gov/32680236
https://pubmed.ncbi.nlm.nih.gov/32680236
Autor:
Gerardo Hernandez-Sosa, Kai Giringer, Stefan Schlisske, Christine Rosenauer, Svenja Morsbach, Kurt Kremer, Uli Lemmer, Tobias Rödlmeier, Kostas Ch. Daoulas, Jasper J. Michels
Publikováno v:
Advanced Materials Technologies
Advanced materials technologies, 6 (2), Art.Nr. 2000335
Advanced materials technologies, 6 (2), Art.Nr. 2000335
The utilization of solution���processable organic semiconducting (OSC) polymers and the development of industrial���relevant printing techniques enable cost���efficient fabrication of optoelectronic devices for the mass market. Yet,
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::84ce1d56bc67f36c2afb96f8f051fe47
https://hdl.handle.net/21.11116/0000-0009-67C6-421.11116/0000-0009-67C8-2
https://hdl.handle.net/21.11116/0000-0009-67C6-421.11116/0000-0009-67C8-2
Publikováno v:
Macromolecules
Recently, disordered blends of semiconducting and insulating polymers have been used to prepare light-emitting diodes with increased luminous efficiency. Because the thermodynamic stability of the disordered phase in blends is limited, equivalent dib
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::3fa1c51d3af9035d7b77708ad257697f
https://hdl.handle.net/21.11116/0000-0005-86CF-B21.11116/0000-0005-A7EE-3
https://hdl.handle.net/21.11116/0000-0005-86CF-B21.11116/0000-0005-A7EE-3
Autor:
Rachel A. Segalman, Wenmin Xu, Cristina Greco, Amaia Agirre, John C. de Mello, Natalie Stingelin, James H. Bannock, Kostas Ch. Daoulas, Jaime Martín, Emily C. Davidson
Publikováno v:
Chemistry of Materials. 30:748-761
Electronic and optical properties of conjugated polymers are strongly affected by their solid-state microstructure. In nematic polymers, mesoscopic order and structure can be theoretically understood using Maier-Saupe (MS) models, motivating us to ap
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::0efa2a3a8b5c3ac179ab8c838164ebbc
https://doi.org/10.1021/acs.chemmater.7b04194
https://doi.org/10.1021/acs.chemmater.7b04194
Publikováno v:
Soft Matter. 14:5898-5905
We establish a macroscopic description of the splay--density coupling in semiflexible main-chain nematic polymers with hairpins, using a vectorial continuity constraint for the "recovered" polar order of the chain tangents and introducing chain backf
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::dddf78feccce3510eeda0c1eda20b4c9
https://doi.org/10.1039/c8sm00835c
https://doi.org/10.1039/c8sm00835c
Publikováno v:
Macromolecules
We develop a generic coarse-grained model of soluble conjugated polymers, capable of describing their self-assembly into a lamellar mesophase. Polymer chains are described by a hindered-rotation model, where interaction centers represent entire repea
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::ebc40bb1f3810d63fc325023ef845a4a
https://hdl.handle.net/21.11116/0000-0003-1371-821.11116/0000-0003-1373-6
https://hdl.handle.net/21.11116/0000-0003-1371-821.11116/0000-0003-1373-6