Please use this identifier to cite or link to this item:
Full metadata record
DC FieldValueLanguage
dc.contributor.authorHossein Karimian, SM-
dc.contributor.authorNajafi, HR-
dc.contributor.authorArabghahestani, M-
dc.contributor.author4th Micro and Nano Flows Conference (MNF2014)-
dc.identifier.citation4th Micro and Nano Flows Conference, University College London, UK, 7-10 September 2014, Editors CS König, TG Karayiannis and S. Balabanien_US
dc.descriptionThis paper was presented at the 4th Micro and Nano Flows Conference (MNF2014), which was held at University College, London, UK. The conference was organised by Brunel University and supported by the Italian Union of Thermofluiddynamics, IPEM, the Process Intensification Network, the Institution of Mechanical Engineers, the Heat Transfer Society, HEXAG - the Heat Exchange Action Group, and the Energy Institute, ASME Press, LCN London Centre for Nanotechnology, UCL University College London, UCL Engineering, the International NanoScience Community,
dc.description.abstractNumerical modeling of nano/micro devices needs measurement of thermo-fluid properties in molecular simulations. Therefore, special attention has been paid to the method of numerical measurement of fluid properties. Details about pressure calculation in a molecular system and its sensitivity to approximations made are studied in this paper. Convergence behavior of kinetic and potential parts of pressure and the effect of cut-off distance on pressure calculation in different bin sizes are studied. Finally a method is introduced for the correct calculation of pressure. This method is based on the assumption that macroscopic properties should be independent from the bin sizes.en_US
dc.publisherBrunel University Londonen_US
dc.relation.ispartofseriesID 183-
dc.subjectNano fluiden_US
dc.subjectMolecular dynamicsen_US
dc.subjectBin sizeen_US
dc.titleDetails about pressure calculation in molecular dynamic analysisen_US
dc.typeConference Paperen_US
Appears in Collections:Brunel Institute for Bioengineering (BIB)
The Brunel Collection

Files in This Item:
File Description SizeFormat 
mnf2014_pressure_najafi-1.pdf141.86 kBAdobe PDFView/Open

Items in BURA are protected by copyright, with all rights reserved, unless otherwise indicated.