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DEVELOPMENT OF PREDICTIVE MODELS FOR INFINITE DILUTIONACTIVITY COEFFICIENTOF ALCOHOLIN IONIC LIQUIDSUSING GROUP CONTRIBUTION METHOD

Group contribution method (GCM) is appliedto develop predictive modelsfor the estimation of the infinite dilution activity coefficient (IDAC) of alcoholin ionic liquids (ILs).The existingnumber of more than 1018 ILs made it unpractical to measure IDAC valuesexperimentally for each synthesized ILs. T...

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主要作者: THANGARAJOO, NANTHINIE
格式: Thesis
語言:English
出版: 2020
主題:
TP Chemical technology
在線閱讀:http://utpedia.utp.edu.my/id/eprint/20433/1/Nanthinie%20Thangarajoo_16004730.pdf
http://utpedia.utp.edu.my/id/eprint/20433/
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spelling oai:utpedia.utp.edu.my:204332024-07-25T06:09:32Z http://utpedia.utp.edu.my/id/eprint/20433/ DEVELOPMENT OF PREDICTIVE MODELS FOR INFINITE DILUTIONACTIVITY COEFFICIENTOF ALCOHOLIN IONIC LIQUIDSUSING GROUP CONTRIBUTION METHOD THANGARAJOO, NANTHINIE TP Chemical technology Group contribution method (GCM) is appliedto develop predictive modelsfor the estimation of the infinite dilution activity coefficient (IDAC) of alcoholin ionic liquids (ILs).The existingnumber of more than 1018 ILs made it unpractical to measure IDAC valuesexperimentally for each synthesized ILs. Thus, developing GCM model is more convenient when compared to other thermodynamics models which requires 3 or more parameters. In this work, two van’tHoff models consist of two (Model I) and three parameters (Model II) are used to calculate the value of IDAC using multiple linear regression (MLR) method and optimized by generalized reduced gradient (GRG) non-linear algorithm in order to obtain a similar value from both experimental and predicted data points 2020-12 Thesis NonPeerReviewed application/pdf en http://utpedia.utp.edu.my/id/eprint/20433/1/Nanthinie%20Thangarajoo_16004730.pdf THANGARAJOO, NANTHINIE (2020) DEVELOPMENT OF PREDICTIVE MODELS FOR INFINITE DILUTIONACTIVITY COEFFICIENTOF ALCOHOLIN IONIC LIQUIDSUSING GROUP CONTRIBUTION METHOD. Masters thesis, Universiti Teknologi PETRONAS.
institution Universiti Teknologi Petronas
building UTP Resource Centre
collection Institutional Repository
continent Asia
country Malaysia
content_provider Universiti Teknologi Petronas
content_source UTP Electronic and Digitized Intellectual Asset
url_provider http://utpedia.utp.edu.my/
language English
topic TP Chemical technology
spellingShingle TP Chemical technology
THANGARAJOO, NANTHINIE
DEVELOPMENT OF PREDICTIVE MODELS FOR INFINITE DILUTIONACTIVITY COEFFICIENTOF ALCOHOLIN IONIC LIQUIDSUSING GROUP CONTRIBUTION METHOD
description Group contribution method (GCM) is appliedto develop predictive modelsfor the estimation of the infinite dilution activity coefficient (IDAC) of alcoholin ionic liquids (ILs).The existingnumber of more than 1018 ILs made it unpractical to measure IDAC valuesexperimentally for each synthesized ILs. Thus, developing GCM model is more convenient when compared to other thermodynamics models which requires 3 or more parameters. In this work, two van’tHoff models consist of two (Model I) and three parameters (Model II) are used to calculate the value of IDAC using multiple linear regression (MLR) method and optimized by generalized reduced gradient (GRG) non-linear algorithm in order to obtain a similar value from both experimental and predicted data points
format Thesis
author THANGARAJOO, NANTHINIE
author_facet THANGARAJOO, NANTHINIE
author_sort THANGARAJOO, NANTHINIE
title DEVELOPMENT OF PREDICTIVE MODELS FOR INFINITE DILUTIONACTIVITY COEFFICIENTOF ALCOHOLIN IONIC LIQUIDSUSING GROUP CONTRIBUTION METHOD
title_short DEVELOPMENT OF PREDICTIVE MODELS FOR INFINITE DILUTIONACTIVITY COEFFICIENTOF ALCOHOLIN IONIC LIQUIDSUSING GROUP CONTRIBUTION METHOD
title_full DEVELOPMENT OF PREDICTIVE MODELS FOR INFINITE DILUTIONACTIVITY COEFFICIENTOF ALCOHOLIN IONIC LIQUIDSUSING GROUP CONTRIBUTION METHOD
title_fullStr DEVELOPMENT OF PREDICTIVE MODELS FOR INFINITE DILUTIONACTIVITY COEFFICIENTOF ALCOHOLIN IONIC LIQUIDSUSING GROUP CONTRIBUTION METHOD
title_full_unstemmed DEVELOPMENT OF PREDICTIVE MODELS FOR INFINITE DILUTIONACTIVITY COEFFICIENTOF ALCOHOLIN IONIC LIQUIDSUSING GROUP CONTRIBUTION METHOD
title_sort development of predictive models for infinite dilutionactivity coefficientof alcoholin ionic liquidsusing group contribution method
publishDate 2020
url http://utpedia.utp.edu.my/id/eprint/20433/1/Nanthinie%20Thangarajoo_16004730.pdf
http://utpedia.utp.edu.my/id/eprint/20433/
_version_ 1805891008283541504
score 13.250246

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