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QUANTUM CHEMICAL MODEL FOR LITHIUM ELECTROCHEMICAL INTERCALATION INTO MOLYBDENUM DISULFIDE
(Sociedad Chilena de Química, 2003)
Quantum chemical model for lithium electrochemical intercalation into molybdenum disulfide
(2003)
Voltage- and incremental charge capacity-composition curves for the electrochemical formation of intercalates LixMoS2 were analyzed at the molecular level by developing a quantum chemical model focused on the variation of ...
Heteroscedastic controlled calibration model applied to analytical chemistry
(JOHN WILEY & SONS LTD, 2010)
In chemical analyses performed by laboratories, one faces the problem of determining the concentration of a chemical element in a sample. In practice, one deals with the problem using the so-called linear calibration model, ...
Modeling of syngas composition obtained from fluidized bed gasifiers using Kuhn–Tucker multipliers
(2018-06-01)
This work aims to develop a modified chemical equilibrium model to accurately determine the syngas (synthesis gas) composition obtained from fluidized bed gasifiers. In order to do so, an optimization method was applied ...
Towards a fuzzy logic model for chemical risk assessment by inhalation in laboratories
(Proceedings of the 2015 IEEE 35th Central American and Panama Convention, CONCAPAN 2015, 2015)
This paper presents a computational Fuzzy Logic
Model for chemical hazards risk assessment by inhalation in
laboratories. Some influence factors on chemical risk are
deterministic but not completely measurable. As a ...
APPLICATION OF MODEL PREDICTIVE CONTROL TO BATCH POLYMERIZATION REACTOR
The absence of a stable operational state in polymerization reactors that operates in batches is factor that determine the need of a special control system. In this study, advanced control methodology is implemented for ...
The chemical percolation devolatilization model applied to the devolatilization of coal in high intensity acoustic fields
(Soc Brasileira Quimica, 2002-05-01)
The chemical percolation devolatilization model (CPD) was extended for the prediction of drying and devolatilization of coal particles in high intensity acoustic fields found in Rijke tube reactors. The acoustic oscillations ...