首页> 外文会议>ASME International Conference on Micro/Nanoscale Heat and Mass Transfer >COMPUTATIONAL INVESTIGATION OF GRAPHENE BEHAVIOR UNDER DIFFERENTIAL WATER PRESSURE AND POSSIBLE MASS TRANSFER INFLUENCES
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COMPUTATIONAL INVESTIGATION OF GRAPHENE BEHAVIOR UNDER DIFFERENTIAL WATER PRESSURE AND POSSIBLE MASS TRANSFER INFLUENCES

机译:差分水压下石墨烯行为的计算研究及可能的传质影响

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Because of its unique properties, graphene has attracted the attentions of many academic research groups and recently, the industry. One of the promising applications of the graphene is in micro/nano-sensors, e.g. using it as a pressure sensor. To use it in mechanical-based nano-sensors, it is very important to investigate the mechanical behavior of the nano-sized graphene sheet and its sensitivity to the medium changes applied on its faces. In this work, we use the molecular dynamics MD method and simulate the behavior of graphene sheet under differential water pressure influences. In this regard, a square straight monolayer graphene sheet is placed as a separator diaphragm between two different water boxes having different pressure/density magnitudes. The graphene atoms located on four sides around the graphene sheet are fixed during the simulations. At first, the two water boxes are in the same condition, i.e., they are a copy of each other. Next, the density of one of the water boxes is changed abruptly to impose the desired pressure difference. We also investigate the mass transfer through the imposed graphene sheet and its impact on the achieved graphene sheet behavior in this study. To the authors' knowledge, this is the first study to investigate the graphene behavior in this manner. Indeed, one objective of this work is to find the sensitivity of nanoscale graphene sheet to low and high pressure/density differences by investigating its deflections.
机译:由于其独特的财产,石墨烯已经吸引了许多学术研究小组的关注,最近是该行业的。石墨烯的一个有希望的应用是微/纳米传感器,例如微/纳米传感器。用它作为压力传感器。为了在基于机械的纳米传感器中使用它,研究纳米尺寸的石墨烯片的力学行为及其对施加在其脸上的介质变化的敏感性非常重要。在这项工作中,我们使用分子动力学MD方法,并在差水压影响下模拟石墨烯片的行为。在这方面,方形的直线单层石墨烯片作为分离器膜片置于具有不同压力/密度幅度的两个不同的水箱之间。位于石墨烯片周围的四个侧面的石墨烯原子在模拟期间固定。起初,两个水箱处于相同的条件下,即,它们是彼此的副本。接下来,突然改变一个水箱的密度以施加所需的压力差。我们还研究了通过施加的石墨烯片的质量传递及其对本研究中实现的石墨烯片行为的影响。为了提交人的知识,这是第一次以这种方式调查石墨烯行为的研究。实际上,这项工作的一个目标是通过研究其偏转,找到纳米石墨烯片对低压和高压/密度差的敏感性。

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