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Title:The calculation of the thermodynamical properties in the liquid-gas region
Authors:ID Avsec, Jurij (Author)
ID Marčič, Milan (Author)
Files:.pdf Acta_Chimica_Slovenica_1999_Avsec,_Mari_The_calculation_of_the_thermodynamical_properties_in_the_liquid-gas_region.pdf (108,39 KB)
MD5: 7B1FAB830A894747F7108EAC137D2D09
 
URL http://acta-arhiv.chem-soc.si/46/46-3-375.pdf
 
Language:English
Work type:Scientific work
Typology:1.01 - Original Scientific Article
Organization:FS - Faculty of Mechanical Engineering
Abstract:The paper features the mathematical model of computing phase diagrams and thermodynamic functions of the state in the liquid, gas and two phase domain with the help of statistical thermodynamics. The paper features all important contributions (translation, rotation, internal rotation, vibration, intermolecular potential energy and influenceof electron and nuclei excitation). To calculate the thermodynamic properties of real gases we developed the cluster theory, which yields better results than the classical virial equation. For the realm of real liquids the Johnson-Zollweg-Gubbins model basedon the modified Benedict-Webb-Rubin eqution was applied. The Lennard-Jones intermolecular was used. The analytical resulats are compared with the thermodynamical data and models obtained by classical thermodynamics and show relatively good agreement.
Keywords:thermodynamic, statistical thermodynamic, liquid-gas, thermodynamic properties
Publication status:Published
Publication version:Version of Record
Year of publishing:1999
Number of pages:str. 375-388
Numbering:Letn. 46, št. 3
PID:20.500.12556/DKUM-53263 New window
ISSN:1318-0207
UDC:536.75
ISSN on article:1318-0207
COBISS.SI-ID:4714262 New window
NUK URN:URN:SI:UM:DK:K23GXLSS
Publication date in DKUM:10.07.2015
Views:1169
Downloads:100
Metadata:XML DC-XML DC-RDF
Categories:Misc.
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Record is a part of a journal

Title:Acta Chimica Slovenica
Shortened title:Acta Chim. Slov.
Publisher:Slovensko kemijsko društvo
ISSN:1318-0207
COBISS.SI-ID:14086149 New window

Licences

License:CC BY 4.0, Creative Commons Attribution 4.0 International
Link:http://creativecommons.org/licenses/by/4.0/
Description:This is the standard Creative Commons license that gives others maximum freedom to do what they want with the work as long as they credit the author.
Licensing start date:10.07.2015

Secondary language

Language:Slovenian
Abstract:Članek obravnava matematični model izračuna termodinamičnih veličin stanja v kapljevitem, plinastem in dvofaznem območju s pomočjo statistične termodinamike. Članek obravnava vse pomembne vplive (translacijo, rotacijo, notranjo rotacijo, vibracijo, medmolekularno potencialno energijo kot vpliv vzbujanja elektronov in jeder). Za izračun termodinamičnih veličin stanja realnih plinov smo razvili model gruč, s pomočjo katerega smo dobili boljše rezultate kot s klasično virialno teorijo realnih plinov. Za področje realne kapljevine smo uporabili Johnson-Zollweg-Gubbinsow model, ki je zasnovan na osnovi modificirane Benedict-Webb-Rubinove enačbe stanja. Za medmolekularni potencial smo uporabili Lennard-Jonesov potencial. Analitični izračuni so primerjani s termodinamičnimi podatki in modeli dobljeni s pomočjo klasične termodinamike in kažejo na relativno dobro ujemanje.
Keywords:termodinamika, statistična termodinamika, kapljevina/plin, termodinamične lastnosti


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