Univolatility curves in ternary mixtures: geometry and numerical computation

Nataliya Shcherbakova; Ivonne Rodriguez-Donis; Jens Abildskov; Vincent  Gerbaud

doi:10.1016/B978-0-444-63965-3.50040-4

Univolatility curves in ternary mixtures: geometry and numerical computation

Nataliya Shcherbakova, Ivonne Rodriguez-Donis, Jens Abildskov, Vincent Gerbaud

Research output: Chapter in Book/Report/Conference proceeding › Article in proceedings › Research › peer-review

Abstract

We propose a new non-iterative numerical algorithm allowing computation of all univolatility curves in homogeneous ternary mixtures independently of the presence of the azeotropes. The key point is the concept of generalized univolatility curves in the 3D state space, which allows the main computational part to be reduced to a simple integration of a system of ordinary differential equations.

Original language	English
Title of host publication	Proceedings of the 27th European Symposium on Computer Aided Process Engineering – ESCAPE 27
Editors	Antonio Espuña, Moisès Graells, Luis Puigjaner
Volume	40
Publisher	Elsevier
Publication date	2017
Pages	907-912
ISBN (Electronic)	978-0-444-63965-3
DOIs	https://doi.org/10.1016/B978-0-444-63965-3.50040-4
Publication status	Published - 2017
Event	27th European Symposium on Computer Aided Process Engineering - Barcelona, Spain Duration: 1 Oct 2017 → 5 Oct 2017 Conference number: 27 https://www.elsevier.com/books/27th-european-symposium-on-computer-aided-process-engineering/espuna/978-0-444-63965-3

Conference

Conference	27th European Symposium on Computer Aided Process Engineering
Number	27
Country/Territory	Spain
City	Barcelona
Period	01/10/2017 → 05/10/2017
Internet address	https://www.elsevier.com/books/27th-european-symposium-on-computer-aided-process-engineering/espuna/978-0-444-63965-3

Series	Computer Aided Chemical Engineering
ISSN	1570-7946

Access to Document

10.1016/B978-0-444-63965-3.50040-4

OpenUrl availability

Full text

Cite this

Shcherbakova, N., Rodriguez-Donis, I., Abildskov, J., & Gerbaud, V. (2017). Univolatility curves in ternary mixtures: geometry and numerical computation. In A. Espuña, M. Graells, & L. Puigjaner (Eds.), Proceedings of the 27th European Symposium on Computer Aided Process Engineering – ESCAPE 27 (Vol. 40, pp. 907-912). Elsevier. https://doi.org/10.1016/B978-0-444-63965-3.50040-4

Shcherbakova, Nataliya ; Rodriguez-Donis, Ivonne ; Abildskov, Jens et al. / Univolatility curves in ternary mixtures: geometry and numerical computation. Proceedings of the 27th European Symposium on Computer Aided Process Engineering – ESCAPE 27. editor / Antonio Espuña ; Moisès Graells ; Luis Puigjaner. Vol. 40 Elsevier, 2017. pp. 907-912 (Computer Aided Chemical Engineering).

@inproceedings{faeeb21fcf974148b73c4ad29177518d,

title = "Univolatility curves in ternary mixtures: geometry and numerical computation",

abstract = "We propose a new non-iterative numerical algorithm allowing computation of all univolatility curves in homogeneous ternary mixtures independently of the presence of the azeotropes. The key point is the concept of generalized univolatility curves in the 3D state space, which allows the main computational part to be reduced to a simple integration of a system of ordinary differential equations.",

author = "Nataliya Shcherbakova and Ivonne Rodriguez-Donis and Jens Abildskov and Vincent Gerbaud",

year = "2017",

doi = "10.1016/B978-0-444-63965-3.50040-4",

language = "English",

volume = "40",

series = "Computer Aided Chemical Engineering",

publisher = "Elsevier",

pages = "907--912",

editor = "Espu{\~n}a, {Antonio } and Graells, {Mois{\`e}s } and Puigjaner, {Luis }",

booktitle = "Proceedings of the 27th European Symposium on Computer Aided Process Engineering – ESCAPE 27",

address = "United Kingdom",

note = "27th European Symposium on Computer Aided Process Engineering, ESCAPE 27 ; Conference date: 01-10-2017 Through 05-10-2017",

url = "https://www.elsevier.com/books/27th-european-symposium-on-computer-aided-process-engineering/espuna/978-0-444-63965-3",

}

Shcherbakova, N, Rodriguez-Donis, I, Abildskov, J & Gerbaud, V 2017, Univolatility curves in ternary mixtures: geometry and numerical computation. in A Espuña, M Graells & L Puigjaner (eds), Proceedings of the 27th European Symposium on Computer Aided Process Engineering – ESCAPE 27. vol. 40, Elsevier, Computer Aided Chemical Engineering, pp. 907-912, 27th European Symposium on Computer Aided Process Engineering, Barcelona, Spain, 01/10/2017. https://doi.org/10.1016/B978-0-444-63965-3.50040-4

Univolatility curves in ternary mixtures: geometry and numerical computation. / Shcherbakova, Nataliya; Rodriguez-Donis, Ivonne; Abildskov, Jens et al.
Proceedings of the 27th European Symposium on Computer Aided Process Engineering – ESCAPE 27. ed. / Antonio Espuña; Moisès Graells; Luis Puigjaner. Vol. 40 Elsevier, 2017. p. 907-912 (Computer Aided Chemical Engineering).

Research output: Chapter in Book/Report/Conference proceeding › Article in proceedings › Research › peer-review

TY - GEN

T1 - Univolatility curves in ternary mixtures: geometry and numerical computation

AU - Shcherbakova, Nataliya

AU - Rodriguez-Donis, Ivonne

AU - Abildskov, Jens

AU - Gerbaud, Vincent

N1 - Conference code: 27

PY - 2017

Y1 - 2017

N2 - We propose a new non-iterative numerical algorithm allowing computation of all univolatility curves in homogeneous ternary mixtures independently of the presence of the azeotropes. The key point is the concept of generalized univolatility curves in the 3D state space, which allows the main computational part to be reduced to a simple integration of a system of ordinary differential equations.

AB - We propose a new non-iterative numerical algorithm allowing computation of all univolatility curves in homogeneous ternary mixtures independently of the presence of the azeotropes. The key point is the concept of generalized univolatility curves in the 3D state space, which allows the main computational part to be reduced to a simple integration of a system of ordinary differential equations.

U2 - 10.1016/B978-0-444-63965-3.50040-4

DO - 10.1016/B978-0-444-63965-3.50040-4

M3 - Article in proceedings

VL - 40

T3 - Computer Aided Chemical Engineering

SP - 907

EP - 912

BT - Proceedings of the 27th European Symposium on Computer Aided Process Engineering – ESCAPE 27

A2 - Espuña, Antonio

A2 - Graells, Moisès

A2 - Puigjaner, Luis

PB - Elsevier

T2 - 27th European Symposium on Computer Aided Process Engineering

Y2 - 1 October 2017 through 5 October 2017

ER -

Shcherbakova N, Rodriguez-Donis I, Abildskov J, Gerbaud V. Univolatility curves in ternary mixtures: geometry and numerical computation. In Espuña A, Graells M, Puigjaner L, editors, Proceedings of the 27th European Symposium on Computer Aided Process Engineering – ESCAPE 27. Vol. 40. Elsevier. 2017. p. 907-912. (Computer Aided Chemical Engineering). doi: 10.1016/B978-0-444-63965-3.50040-4

Univolatility curves in ternary mixtures: geometry and numerical computation

Abstract

Conference

Access to Document

OpenUrl availability

Fingerprint

Cite this