Matches in SemOpenAlex for { <https://semopenalex.org/work/W2005165136> ?p ?o ?g. }
- W2005165136 endingPage "4014" @default.
- W2005165136 startingPage "4008" @default.
- W2005165136 abstract "Atomic scale simulations of polymer materials is a topic of interest since it permits to reduce costly experiments to determine their physicochemical properties. In this context, modeling heterogeneously ordered multichain systems such as amorphous polymers, remains a challenging problem. A recently proposed two-step method consists of iteratively generating the structures using a simplified energy model, and subsequently relaxing the system, considering a more accurate model, in order to reduce its potential energy. This work proposes an improvement of this method by integrating a novel relaxation technique, which applies analytical rebridging moves inspired by robotics. A comparative analysis using models of amorphous polyethylene with different sizes and densities shows that the rebridging scheme described here is very effective for the simulation of long alkanes." @default.
- W2005165136 created "2016-06-24" @default.
- W2005165136 creator A5029593023 @default.
- W2005165136 creator A5033713946 @default.
- W2005165136 creator A5064253835 @default.
- W2005165136 creator A5073142247 @default.
- W2005165136 creator A5091819577 @default.
- W2005165136 date "2010-08-01" @default.
- W2005165136 modified "2023-10-18" @default.
- W2005165136 title "Relaxation of amorphous multichain polymer systems using inverse kinematics" @default.
- W2005165136 cites W1551220465 @default.
- W2005165136 cites W1917515737 @default.
- W2005165136 cites W1965249348 @default.
- W2005165136 cites W1969440997 @default.
- W2005165136 cites W1974192563 @default.
- W2005165136 cites W1985243486 @default.
- W2005165136 cites W1995116238 @default.
- W2005165136 cites W1998470735 @default.
- W2005165136 cites W1999062034 @default.
- W2005165136 cites W2003670327 @default.
- W2005165136 cites W2005979551 @default.
- W2005165136 cites W2012986398 @default.
- W2005165136 cites W20209969 @default.
- W2005165136 cites W2022592354 @default.
- W2005165136 cites W2025872176 @default.
- W2005165136 cites W2041080217 @default.
- W2005165136 cites W2048118231 @default.
- W2005165136 cites W2048501207 @default.
- W2005165136 cites W2049004859 @default.
- W2005165136 cites W2050504889 @default.
- W2005165136 cites W2053449789 @default.
- W2005165136 cites W2055173656 @default.
- W2005165136 cites W2055355547 @default.
- W2005165136 cites W2064048356 @default.
- W2005165136 cites W2067484689 @default.
- W2005165136 cites W2067839394 @default.
- W2005165136 cites W2069126311 @default.
- W2005165136 cites W2074006125 @default.
- W2005165136 cites W2082950643 @default.
- W2005165136 cites W2089311544 @default.
- W2005165136 cites W2091351360 @default.
- W2005165136 cites W2092379189 @default.
- W2005165136 cites W2093387582 @default.
- W2005165136 cites W2115590079 @default.
- W2005165136 cites W2137604324 @default.
- W2005165136 cites W2149186423 @default.
- W2005165136 cites W2154297157 @default.
- W2005165136 cites W2155524113 @default.
- W2005165136 cites W2162080910 @default.
- W2005165136 cites W3104897282 @default.
- W2005165136 cites W4247565662 @default.
- W2005165136 doi "https://doi.org/10.1016/j.polymer.2010.06.019" @default.
- W2005165136 hasPublicationYear "2010" @default.
- W2005165136 type Work @default.
- W2005165136 sameAs 2005165136 @default.
- W2005165136 citedByCount "7" @default.
- W2005165136 countsByYear W20051651362012 @default.
- W2005165136 countsByYear W20051651362014 @default.
- W2005165136 countsByYear W20051651362018 @default.
- W2005165136 countsByYear W20051651362023 @default.
- W2005165136 crossrefType "journal-article" @default.
- W2005165136 hasAuthorship W2005165136A5029593023 @default.
- W2005165136 hasAuthorship W2005165136A5033713946 @default.
- W2005165136 hasAuthorship W2005165136A5064253835 @default.
- W2005165136 hasAuthorship W2005165136A5073142247 @default.
- W2005165136 hasAuthorship W2005165136A5091819577 @default.
- W2005165136 hasConcept C121332964 @default.
- W2005165136 hasConcept C121864883 @default.
- W2005165136 hasConcept C151730666 @default.
- W2005165136 hasConcept C15744967 @default.
- W2005165136 hasConcept C159985019 @default.
- W2005165136 hasConcept C185592680 @default.
- W2005165136 hasConcept C186060115 @default.
- W2005165136 hasConcept C18762648 @default.
- W2005165136 hasConcept C192562407 @default.
- W2005165136 hasConcept C2524010 @default.
- W2005165136 hasConcept C2776029896 @default.
- W2005165136 hasConcept C2776479032 @default.
- W2005165136 hasConcept C2778755073 @default.
- W2005165136 hasConcept C2779343474 @default.
- W2005165136 hasConcept C33923547 @default.
- W2005165136 hasConcept C41008148 @default.
- W2005165136 hasConcept C521977710 @default.
- W2005165136 hasConcept C56052488 @default.
- W2005165136 hasConcept C62520636 @default.
- W2005165136 hasConcept C77805123 @default.
- W2005165136 hasConcept C8010536 @default.
- W2005165136 hasConcept C86803240 @default.
- W2005165136 hasConcept C97355855 @default.
- W2005165136 hasConceptScore W2005165136C121332964 @default.
- W2005165136 hasConceptScore W2005165136C121864883 @default.
- W2005165136 hasConceptScore W2005165136C151730666 @default.
- W2005165136 hasConceptScore W2005165136C15744967 @default.
- W2005165136 hasConceptScore W2005165136C159985019 @default.
- W2005165136 hasConceptScore W2005165136C185592680 @default.
- W2005165136 hasConceptScore W2005165136C186060115 @default.
- W2005165136 hasConceptScore W2005165136C18762648 @default.
- W2005165136 hasConceptScore W2005165136C192562407 @default.