A numerical study of the effect of graphene nanoparticle size on brownian displacement, thermophoresis, and thermal performance of graphene/water nanofluid by molecular dynamics simulation

Brownian motion, often known as BM, is an inherent characteristic of minute particles suspended in a fluid. It plays an important role in several physical and chemical processes. Thermophoresis refers to the process where particles in a fluid are carried along with a gradient in temperature (Temp)....

Full description

Saved in:
Bibliographic Details
Main Authors: Heider H.J. Almutter, Waqed H. Hassan, Shaymaa Abed Hussein, Dheyaa J. Jasim, Soheil Salahshour, Nafiseh Emami
Format: Article
Language:English
Published: Elsevier 2024-11-01
Series:International Journal of Thermofluids
Subjects:
Online Access:http://www.sciencedirect.com/science/article/pii/S2666202724003677
Tags: Add Tag
No Tags, Be the first to tag this record!
_version_ 1849220473629442048
author Heider H.J. Almutter
Waqed H. Hassan
Shaymaa Abed Hussein
Dheyaa J. Jasim
Soheil Salahshour
Nafiseh Emami
author_facet Heider H.J. Almutter
Waqed H. Hassan
Shaymaa Abed Hussein
Dheyaa J. Jasim
Soheil Salahshour
Nafiseh Emami
author_sort Heider H.J. Almutter
collection DOAJ
description Brownian motion, often known as BM, is an inherent characteristic of minute particles suspended in a fluid. It plays an important role in several physical and chemical processes. Thermophoresis refers to the process where particles in a fluid are carried along with a gradient in temperature (Temp). This feature has significant importance in several applications, including microfluidics, thermal control, and energy conversion. Through the examination of the thermophoresis phenomenon in water/graphene nanofluid (NF), researchers might get valuable knowledge on the potential uses of these materials. The current study examined the effect of various sizes of graphene nanoparticles (NPs) (5, 6, 9, and 10 Å) on the thermal behavior (TB), BM, and thermophoresis of water/graphene NF using molecular dynamics (MD) simulation. This study reported the changes in heat flux (HF), thermal conductivity (TC), average Brownian displacement (BD), and thermophoresis. It is concluded that by increasing the size of graphene NPs from 5 to 10 Å, the average BD and thermophoresis increased from 3.06 Å and 23.88 Å to 4.16 Å and 31.46 Å, respectively. Due to their higher kinetic energy (KE) and momentum, larger graphene NPs experienced more BM, enabling them to withstand random thermal fluctuations more effectively than smaller particles. In addition, as the size of graphene NPs increased, the HF and TC values ​​increased from 39.54 W/m2 and 0.36 W/(m.K) to 47.19 W/m2 and 0.51 W/(m.K) after 10 ns. Therefore, the size-dependent changes in BD and thermophoretic effects led to a simultaneous increase in HF and TC of the NF, which was attributed to the larger heat transfer (HT) surface area, improved HT properties, and synergistic effects of larger graphene NPs. The maximum (Max) temperature increases from 1415 K to 1504 K. These findings were useful in a variety of industries, particularly for improving TB in different NFs.
format Article
id doaj-art-ece58afa5f6d41d3a328fecdfc6e75aa
institution Kabale University
issn 2666-2027
language English
publishDate 2024-11-01
publisher Elsevier
record_format Article
series International Journal of Thermofluids
spelling doaj-art-ece58afa5f6d41d3a328fecdfc6e75aa2024-12-13T11:04:24ZengElsevierInternational Journal of Thermofluids2666-20272024-11-0124100927A numerical study of the effect of graphene nanoparticle size on brownian displacement, thermophoresis, and thermal performance of graphene/water nanofluid by molecular dynamics simulationHeider H.J. Almutter0Waqed H. Hassan1Shaymaa Abed Hussein2Dheyaa J. Jasim3Soheil Salahshour4Nafiseh Emami5Department of Chemical Engineering, Faculty of Engineering, University of Basrah, Basrah, IraqUniversity of Warith Al-Anbiyaa, Kerbala, 56001, Iraq; Department of Civil Engineering, College of Engineering, University of Kerbala, Kerbala, 56001, IraqDepartment of pathological analyzes, Al Manara College for Medical Sciences, Maysan, IraqDepartment of chemical engineering and petroleum industries, Al-Amarah University College, Maysan, Iraq; Corresponding authors.Faculty of Engineering and Natural Sciences, Istanbul Okan University, Istanbul, Turkey; Faculty of Engineering and Natural Sciences, Bahcesehir University, Istanbul, Turkey; Department of Computer Science and Mathematics, Lebanese American University, Beirut, LebanonDepartment of Chemical Engineering, Faculty of Engineering, Isfahan University, Iran; Corresponding authors.Brownian motion, often known as BM, is an inherent characteristic of minute particles suspended in a fluid. It plays an important role in several physical and chemical processes. Thermophoresis refers to the process where particles in a fluid are carried along with a gradient in temperature (Temp). This feature has significant importance in several applications, including microfluidics, thermal control, and energy conversion. Through the examination of the thermophoresis phenomenon in water/graphene nanofluid (NF), researchers might get valuable knowledge on the potential uses of these materials. The current study examined the effect of various sizes of graphene nanoparticles (NPs) (5, 6, 9, and 10 Å) on the thermal behavior (TB), BM, and thermophoresis of water/graphene NF using molecular dynamics (MD) simulation. This study reported the changes in heat flux (HF), thermal conductivity (TC), average Brownian displacement (BD), and thermophoresis. It is concluded that by increasing the size of graphene NPs from 5 to 10 Å, the average BD and thermophoresis increased from 3.06 Å and 23.88 Å to 4.16 Å and 31.46 Å, respectively. Due to their higher kinetic energy (KE) and momentum, larger graphene NPs experienced more BM, enabling them to withstand random thermal fluctuations more effectively than smaller particles. In addition, as the size of graphene NPs increased, the HF and TC values ​​increased from 39.54 W/m2 and 0.36 W/(m.K) to 47.19 W/m2 and 0.51 W/(m.K) after 10 ns. Therefore, the size-dependent changes in BD and thermophoretic effects led to a simultaneous increase in HF and TC of the NF, which was attributed to the larger heat transfer (HT) surface area, improved HT properties, and synergistic effects of larger graphene NPs. The maximum (Max) temperature increases from 1415 K to 1504 K. These findings were useful in a variety of industries, particularly for improving TB in different NFs.http://www.sciencedirect.com/science/article/pii/S2666202724003677Brownian displacementThermophoresisThermal behaviorMolecular dynamics simulationGraphene/ water nanofluid
spellingShingle Heider H.J. Almutter
Waqed H. Hassan
Shaymaa Abed Hussein
Dheyaa J. Jasim
Soheil Salahshour
Nafiseh Emami
A numerical study of the effect of graphene nanoparticle size on brownian displacement, thermophoresis, and thermal performance of graphene/water nanofluid by molecular dynamics simulation
International Journal of Thermofluids
Brownian displacement
Thermophoresis
Thermal behavior
Molecular dynamics simulation
Graphene/ water nanofluid
title A numerical study of the effect of graphene nanoparticle size on brownian displacement, thermophoresis, and thermal performance of graphene/water nanofluid by molecular dynamics simulation
title_full A numerical study of the effect of graphene nanoparticle size on brownian displacement, thermophoresis, and thermal performance of graphene/water nanofluid by molecular dynamics simulation
title_fullStr A numerical study of the effect of graphene nanoparticle size on brownian displacement, thermophoresis, and thermal performance of graphene/water nanofluid by molecular dynamics simulation
title_full_unstemmed A numerical study of the effect of graphene nanoparticle size on brownian displacement, thermophoresis, and thermal performance of graphene/water nanofluid by molecular dynamics simulation
title_short A numerical study of the effect of graphene nanoparticle size on brownian displacement, thermophoresis, and thermal performance of graphene/water nanofluid by molecular dynamics simulation
title_sort numerical study of the effect of graphene nanoparticle size on brownian displacement thermophoresis and thermal performance of graphene water nanofluid by molecular dynamics simulation
topic Brownian displacement
Thermophoresis
Thermal behavior
Molecular dynamics simulation
Graphene/ water nanofluid
url http://www.sciencedirect.com/science/article/pii/S2666202724003677
work_keys_str_mv AT heiderhjalmutter anumericalstudyoftheeffectofgraphenenanoparticlesizeonbrowniandisplacementthermophoresisandthermalperformanceofgraphenewaternanofluidbymoleculardynamicssimulation
AT waqedhhassan anumericalstudyoftheeffectofgraphenenanoparticlesizeonbrowniandisplacementthermophoresisandthermalperformanceofgraphenewaternanofluidbymoleculardynamicssimulation
AT shaymaaabedhussein anumericalstudyoftheeffectofgraphenenanoparticlesizeonbrowniandisplacementthermophoresisandthermalperformanceofgraphenewaternanofluidbymoleculardynamicssimulation
AT dheyaajjasim anumericalstudyoftheeffectofgraphenenanoparticlesizeonbrowniandisplacementthermophoresisandthermalperformanceofgraphenewaternanofluidbymoleculardynamicssimulation
AT soheilsalahshour anumericalstudyoftheeffectofgraphenenanoparticlesizeonbrowniandisplacementthermophoresisandthermalperformanceofgraphenewaternanofluidbymoleculardynamicssimulation
AT nafisehemami anumericalstudyoftheeffectofgraphenenanoparticlesizeonbrowniandisplacementthermophoresisandthermalperformanceofgraphenewaternanofluidbymoleculardynamicssimulation
AT heiderhjalmutter numericalstudyoftheeffectofgraphenenanoparticlesizeonbrowniandisplacementthermophoresisandthermalperformanceofgraphenewaternanofluidbymoleculardynamicssimulation
AT waqedhhassan numericalstudyoftheeffectofgraphenenanoparticlesizeonbrowniandisplacementthermophoresisandthermalperformanceofgraphenewaternanofluidbymoleculardynamicssimulation
AT shaymaaabedhussein numericalstudyoftheeffectofgraphenenanoparticlesizeonbrowniandisplacementthermophoresisandthermalperformanceofgraphenewaternanofluidbymoleculardynamicssimulation
AT dheyaajjasim numericalstudyoftheeffectofgraphenenanoparticlesizeonbrowniandisplacementthermophoresisandthermalperformanceofgraphenewaternanofluidbymoleculardynamicssimulation
AT soheilsalahshour numericalstudyoftheeffectofgraphenenanoparticlesizeonbrowniandisplacementthermophoresisandthermalperformanceofgraphenewaternanofluidbymoleculardynamicssimulation
AT nafisehemami numericalstudyoftheeffectofgraphenenanoparticlesizeonbrowniandisplacementthermophoresisandthermalperformanceofgraphenewaternanofluidbymoleculardynamicssimulation