Computational Models of Thermal Cycling in Chemical Systems
نویسندگان
چکیده
منابع مشابه
suppression of coke formation in thermal cracking by coke inhibitors
the main purpose of this research was to:1.develop a coking model for thermal cracking of naphtha.2.study coke inhibition methods using different coke inhibitors.developing a coking model in naphtha cracking reactors requires a suitable model of the thermal cracking reactor based on a reliable kinetic model.to obtain reliable results all these models shall be solved simultaneously.for this pu...
15 صفحه اولComputational and experimental models of thermal cycling to break chiral symmetry
Computational modeling of reaction systems can provide a strong foundation for experimental investigations. In this investigation, we first propose a unique theoretical system for breaking chiral symmetry that utilizes thermal cycling to amplify a small initial asymmetry. Unlike models in the literature, no autocatalytic reactions were needed for homochirality in this model to emerge. Following...
متن کاملComputational Chemical Dynamics of Complex Systems
We are focusing on addressing the challenges of accurately treating both the energetics and dynamics of molecular processes in both gas and condensed phases. The project includes tools for calculating reaction rates and transport properties and for investigating energetic processes, catalysis, and dynamics. We have developed protocols for calculating relevant thermodynamic and kinetic parameter...
متن کاملComputational Models of Grounding in Collaborative Systems
In this paper, I present in detail two models of grounding, Clark and Schaefer’s contribution model, and the grounding acts model from my previous work. Description of each model is accompanied with discussion of it’s limitations, particularly with respect to use within a collaborative system. Also presented is an approach taking factors such as media costs into account.
متن کاملComplex Systems Analysis of Cell Cycling Models in Carcinogenesis
Carcinogenesis is a complex process that involves dynamically inter-connected modular subnetworks that evolve under the influence of micro-environmental, as well as, in many cases, cancer therapy-induced perturbations, in non-random, pseudo-Markov chain processes. An appropriate n-stage model of carcinogenesis involves therefore n-valued Logic treatments of such processes, nonlinear dynamic tra...
متن کاملذخیره در منابع من
با ذخیره ی این منبع در منابع من، دسترسی به آن را برای استفاده های بعدی آسان تر کنید
ژورنال
عنوان ژورنال: International Journal of Chemistry
سال: 2010
ISSN: 1916-9701,1916-9698
DOI: 10.5539/ijc.v2n2p19