Investigation of a Complex Reaction Network: II. Kinetics, Mechanism and Parameter Estimation

Conventional Strategies for Discrimination of Intrinsic and Apparent Kinetics from Crushed- and Whole-Catalyst-Pellet Experimental Data, Respectively, Do Not Yield Satisfactory Results for the Reaction Network in the Manufacture of Α-Aminomethyl-2-Furanmethanol (Aminoalcohol) from Α-Nitromethyl-2-Furanmethanol (Nitroalcohol). Laboratory Trickle-Bed Reactor Tests in the Range of Concentration and Product Yield of Commercial Interest Are Utilized to Yield a Reasonable Set of Kinetic Parameters, Which Are Otherwise Unobtainable. This is Accomplished by Proposing a Reaction Network, a Plausible Mechanism, and Optimizing the Kinetic Parameters based on the Reactor-Model-Generated Performance Data to Fit Experimental Output Concentrations of All Species for the Entire Set of Experiments. a Complex Reaction Network for the Key Reactions in the System is Developed based on the Reaction Scheme in Part I. Fitting of Trickle-Bed Reactor Data to This Model is Attempted to Yield an Insight into the Actual Kinetics. the Results Show Promise of Obtaining an overall Network Kinetic Model, Even with the Limited Data Available

Investigation of a Complex Reaction Network: I. Experiments in a High-Pressure Trickle-Bed Reactor

A High-Pressure Trickle-Bed Reactor Was Used to Achieve High Productivity and Selectivity for the Manufacture of a Key Herbicide Intermediate (Α-Aminomethyl-2-Furanmethanol (Amino Alcohol, AA) from Α-Nitromethyl-2-Furanmethanol (Nitro Alcohol, NA). Raney Nickel Catalysts of Varying Activity Were Prescreened for Suitability in Trickle-Bed Operation. the Effect of Operating Parameters Such as Reactant Feed Concentration, Liquid Mass Velocity, and Temperature on the Yield of Amino Alcohol (AA) for RNi-A Are Discussed. the Superiority of Trickle-Bed Reactors over Others Such as Semibatch and Batch Slurry Systems is Demonstrated. the AA Yield Increases with Decrease in Feed Reactant Concentration and Liquid Mass Velocity, as Well as with Lowering of the Operating Temperature. a Maximum Product Yield of 90.1% Was Obtained at 8.3 Wt. % Feed Concentration of Nitroalcohol (NA), While at the Highest Feed Concentration of 40 Wt. % NA, the Maximum Product Yield Was 58%. the Volumetric Productivity of AA Was Significantly Higher at Higher Reactant Feed Concentrations, Even Though the Yield Was Lower under These Conditions. the Operating Temperature Was Also an Important Parameter, with a Lower Temperature Being Preferable for Trickle-Bed Experiments. Bed Dilution with Inert Fines Improved Catalyst Utilization and Increased the AA Yield and Productivity in the Laboratory-Scale Trickle-Bed Reactor

Cross-syndrome comparison of real-world executive functioning and problem solving using a new problem-solving questionnaire

Background. Individuals with neurodevelopmental disorders like Williams syndrome and Down syndrome exhibit executive function impairments on experimental tasks (Lanfranchi, Jerman, Dal Pont, Alberti, & Vianello, 2010; Menghini, Addona, Costanzo, & Vicari, 2010), but the way that they use executive functioning for problem solving in everyday life has not hitherto been explored. The study aim is to understand cross-syndrome characteristics of everyday executive functioning and problem solving. Methods. Parents/carers of individuals with Williams syndrome (n=47) or Down syndrome (n=31) of a similar chronological age (m =17 years 4 months and 18 years respectively) as well as those of a group of younger typically developing children (n=34; m=8 years 3 months) completed two questionnaires: the Behavior Rating Inventory of Executive Function (BRIEF; Gioia, Isquith, Guy, & Kenworthy, 2000) and a novel Problem-Solving Questionnaire. Results. The rated likelihood of reaching a solution in a problem solving situation was lower for both syndromic groups than the typical group, and lower still for the Williams syndrome group than the Down syndrome group. The proportion of group members meeting the criterion for clinical significance on the BRIEF was also highest for the Williams syndrome group. While changing response, avoiding losing focus and maintaining perseverance were important for problem-solving success in all groups, asking for help and avoiding becoming emotional were also important for the Down syndrome and Williams syndrome groups respectively. Keeping possessions in order was a relative strength amongst BRIEF scales for the Down syndrome group. Conclusion. Results suggest that individuals with Down syndrome tend to use compensatory strategies for problem solving (asking for help and potentially, keeping items well ordered), while for individuals with Williams syndrome, emotional reactions disrupt their problem- solving skills. This paper highlights the importance of identifying syndrome-specific problem-solving strengths and difficulties to improve effective functioning in everyday life

Dynamics of clustered opinions in complex networks

A simple model for simulating tug of war game as varying the player number in a team is discussed to identify the slow pace of fast change. This model shows that a large number of information sources leads slow change for the system. Also, we introduce an opinion diffusion model including the effect of a high degree of clustering. This model shows that the de facto standard and lock-in effect, well-known phenomena in economics and business management, can be explained by the network clusters.11scopu