Estimation of the interaction energy between small molecules and a silica model as an approach for predicting the interaction order between elastomers and silica

Polymer International

Volumn 58, Issue 7, 2009, Pages 811-816

  Pérez, León D ^a,b   Florez, Elizabeth ^a   Mark, James E ^b   López, Betty L ^a  

^a UNIVERSIDAD DE ANTIOQUIA   (Colombia)

^b UNIVERSITY OF CINCINNATI   (United States)

Author keywords

Elastomer filler interactions; Elastomers; Fillers; Gaussian program computations; Reinforcement; Silica

Indexed keywords

1-ALKENE; 1-ALKENES; COMPUTER PROGRAM; ELECTRON TRANSFER; FAVORABLE INTERACTIONS; FILLER PARTICLES; GAUSSIAN; GAUSSIAN PROGRAM COMPUTATIONS; INTERACTION ENERGIES; INVERSE GAS CHROMATOGRAPHY; POLYMER-FILLER; REINFORCING PARTICLES; SMALL MOLECULES; SUPERPOSITION ERRORS; TWO-COMPONENT;

CHROMATOGRAPHIC ANALYSIS; CYANIDES; ELASTOMERS; GAS CHROMATOGRAPHY; HYDROGEN; HYDROGEN BONDS; MECHANICAL PROPERTIES; OLEFINS; REINFORCED PLASTICS; REINFORCEMENT; RUBBER; SILICA;

FILLERS;

CHROMATOGRAPHY; ELASTOMER; FILLING MATERIAL; MECHANICAL PROPERTY; NANOCOMPOSITE; REINFORCEMENT;

EID: 67849114416     PISSN: 09598103     EISSN: 10970126     Source Type: Journal    
DOI: 10.1002/pi.2596     Document Type: Article

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