Using molecular dynamics simulation to investigate the number of wall layers and pyramidal surface roughness on atomic behavior and boiling characteristics of water/Fe nanofluid flow

In today's heating and cooling industry, all investigators assume environmentally friendly and economic procedures because of environmental and energy crisis issues. Boiling heat transfer (BHT) is one of the impressive heat transfer (HT) procedures known in various engineering applications. The thermal con-ductivity of nanoparticles (NPs) is several times that of the base fluid. One way to amend a fluid's ther-mophysical attributes is to utilize nanofluids (NFs) as boiling fluid. In this research, Fe NPs have been used in the water-based fluid. Fe NPs to the base fluid for reasons like enhancement of the HT surface, enhancement of the heat capacity of the fluid, enhancement of the effective thermal conductivity, and monotony of the temperature gradient in the fluid cause a substantial enhancement in HT coefficient. So far, the effect of phase change time and the effects of pyramidal surface height on the Fe/water NF have been rarely done numerically using molecular dynamics simulation (MDS). The main purpose of the cur-rent modeling is to improve the atomic behavior and pool boiling heat transfer (PBHT) of water/Fe NF. This paper investigates the effect of atomic layers and atomic pyramidal surface roughness (SR) with dif-ferent heights on atomic behavior and PBHT by the MDS. The outcomes display that increasing the num-ber of layers increases the maximum density value from 0.029 to 0.033 atom/A3 and reduces the maximum temperature from 789 K to 653 K. The increase in the number of atomic layers in the microchannel (MC) wall corresponds to the decrease in heat flux (HF) in the MC. With addition of pyra-midal SR, the HF in the MC increases.(c) 2022 Elsevier B.V. All rights reserved.