FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W2411330310> ?p ?o ?g. }

• W2411330310 abstract "We present a multiscale model, based on molecular dynamics (MD) and kinetic Monte Carlo (kMC), to study the aggregation driven growth of colloidal particles. Coarse-grained molecular dynamics (CGMD) simulations are employed to detect key agglomeration events and calculate the corresponding rate constants. The kMC simulations employ these rate constants in a stochastic framework to track the growth of the agglomerates over longer time scales and length scales. One of the hallmarks of the model is a unique methodology to detect and characterize agglomeration events. The model accounts for individual cluster-scale effects such as change in size due to aggregation as well as local molecular-scale effects such as changes in the number of neighbors of each molecule in a colloidal cluster. Such definition of agglomeration events allows us to grow the cluster to sizes that are inaccessible to molecular simulations as well as track the shape of the growing cluster. A well-studied system, comprising fullerenes in NaCl electrolyte solution, was simulated to validate the model. Under the simulated conditions, the agglomeration process evolves from a diffusion limited cluster aggregation (DLCA) regime to percolating cluster in transition and finally to a gelation regime. Overall the data from the multiscale numerical model shows good agreement with existing theory of colloidal particle growth. Although in the present study we validated our model by specifically simulating fullerene agglomeration in electrolyte solution, the model is versatile and can be applied to a wide range of colloidal systems." @default.
• W2411330310 created "2016-06-24" @default.
• W2411330310 creator A5002048437 @default.
• W2411330310 creator A5031585022 @default.
• W2411330310 creator A5086559737 @default.
• W2411330310 date "2015-07-06" @default.
• W2411330310 modified "2023-10-17" @default.
• W2411330310 title "Combined deterministic-stochastic framework for modeling the agglomeration of colloidal particles" @default.
• W2411330310 cites W1581858536 @default.
• W2411330310 cites W1596951248 @default.
• W2411330310 cites W1965239057 @default.
• W2411330310 cites W1966078827 @default.
• W2411330310 cites W1970078569 @default.
• W2411330310 cites W1970892264 @default.
• W2411330310 cites W1972396457 @default.
• W2411330310 cites W1973617853 @default.
• W2411330310 cites W1977280767 @default.
• W2411330310 cites W1978267105 @default.
• W2411330310 cites W1979155106 @default.
• W2411330310 cites W1983678528 @default.
• W2411330310 cites W1987998963 @default.
• W2411330310 cites W1988677712 @default.
• W2411330310 cites W1989401483 @default.
• W2411330310 cites W1990394864 @default.
• W2411330310 cites W1991632167 @default.
• W2411330310 cites W1996635921 @default.
• W2411330310 cites W1996821584 @default.
• W2411330310 cites W2002052849 @default.
• W2411330310 cites W2002754781 @default.
• W2411330310 cites W2003176548 @default.
• W2411330310 cites W2003375097 @default.
• W2411330310 cites W2004538582 @default.
• W2411330310 cites W2005101538 @default.
• W2411330310 cites W2006118571 @default.
• W2411330310 cites W2007128103 @default.
• W2411330310 cites W2008211756 @default.
• W2411330310 cites W2009075650 @default.
• W2411330310 cites W2009870673 @default.
• W2411330310 cites W2012710474 @default.
• W2411330310 cites W2013594472 @default.
• W2411330310 cites W2018528894 @default.
• W2411330310 cites W2018673054 @default.
• W2411330310 cites W2020783392 @default.
• W2411330310 cites W2024541258 @default.
• W2411330310 cites W2028261043 @default.
• W2411330310 cites W2028441690 @default.
• W2411330310 cites W2029849672 @default.
• W2411330310 cites W2030441944 @default.
• W2411330310 cites W2032213968 @default.
• W2411330310 cites W2035500672 @default.
• W2411330310 cites W2042977597 @default.
• W2411330310 cites W2044160422 @default.
• W2411330310 cites W2048939436 @default.
• W2411330310 cites W2050009296 @default.
• W2411330310 cites W2051553505 @default.
• W2411330310 cites W2051887278 @default.
• W2411330310 cites W2057477511 @default.
• W2411330310 cites W2057950868 @default.
• W2411330310 cites W2059467660 @default.
• W2411330310 cites W2060239109 @default.
• W2411330310 cites W2064645694 @default.
• W2411330310 cites W2067174909 @default.
• W2411330310 cites W2070707743 @default.
• W2411330310 cites W2071837796 @default.
• W2411330310 cites W2071938503 @default.
• W2411330310 cites W2072883698 @default.
• W2411330310 cites W2075984821 @default.
• W2411330310 cites W2077468949 @default.
• W2411330310 cites W2079201604 @default.
• W2411330310 cites W2079309147 @default.
• W2411330310 cites W2081444239 @default.
• W2411330310 cites W2082758261 @default.
• W2411330310 cites W2082907896 @default.
• W2411330310 cites W2093333368 @default.
• W2411330310 cites W2093988152 @default.
• W2411330310 cites W2095938967 @default.
• W2411330310 cites W2098432400 @default.
• W2411330310 cites W2115090101 @default.
• W2411330310 cites W2115432726 @default.
• W2411330310 cites W2119267663 @default.
• W2411330310 cites W2123119329 @default.
• W2411330310 cites W2135503483 @default.
• W2411330310 cites W2137971290 @default.
• W2411330310 cites W2142996228 @default.
• W2411330310 cites W2152150158 @default.
• W2411330310 cites W2156232652 @default.
• W2411330310 cites W2162968826 @default.
• W2411330310 cites W2166949127 @default.
• W2411330310 cites W2321232808 @default.
• W2411330310 cites W2324758928 @default.
• W2411330310 cites W247357342 @default.
• W2411330310 cites W4211190698 @default.
• W2411330310 cites W4231466358 @default.
• W2411330310 cites W4234796278 @default.
• W2411330310 cites W643878296 @default.
• W2411330310 doi "https://doi.org/10.1103/physreve.92.013304" @default.
• W2411330310 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/26274304" @default.
• W2411330310 hasPublicationYear "2015" @default.
• W2411330310 type Work @default.
• W2411330310 sameAs 2411330310 @default.

• next