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Full-Text Articles in Materials Science and Engineering

Decision Rules For The Robotic Mobile Fulfillment System Of A Pcb Assembly Factory Warehouse, Ching-Jung Ting, Hendra Permana, Hsien-Mi Meng Jun 2023

Decision Rules For The Robotic Mobile Fulfillment System Of A Pcb Assembly Factory Warehouse, Ching-Jung Ting, Hendra Permana, Hsien-Mi Meng

International Material Handling Research Colloquium

No abstract provided.


A Fluid Flow Queuing Network Model For Performance Analysis Of Bulk Liquid Terminals, Debjit Roy, Werner Scheinhardt, Jan-Kees Van Ommeren Jun 2023

A Fluid Flow Queuing Network Model For Performance Analysis Of Bulk Liquid Terminals, Debjit Roy, Werner Scheinhardt, Jan-Kees Van Ommeren

International Material Handling Research Colloquium

No abstract provided.


Warehouse Robotization With Wheel.Me Genius: A Puzzle-Based Movable Racks System, Fabio Sgarbossa, Martin Amaral Halseide, Atle Timenes Jun 2023

Warehouse Robotization With Wheel.Me Genius: A Puzzle-Based Movable Racks System, Fabio Sgarbossa, Martin Amaral Halseide, Atle Timenes

International Material Handling Research Colloquium

No abstract provided.


Computational Catalysis: Creating A User-Friendly Tool For Research And Education, Kevin P. Greenman, Peilin Liao Aug 2018

Computational Catalysis: Creating A User-Friendly Tool For Research And Education, Kevin P. Greenman, Peilin Liao

The Summer Undergraduate Research Fellowship (SURF) Symposium

Catalysis is used in a significant portion of production processes in the industrialized world, including most processing of chemicals and fuels. This makes maximizing the efficiency of catalysts a high priority. However, the immense number of candidates for new catalysts precludes the possibility of testing all of them by experiments. Density functional theory (DFT) has been widely and successfully used to calculate material properties relevant to catalysis and to screen promising candidates for experimental testing, but there currently exists no publicly- available, user-friendly tool for performing these DFT calculations. This work details the development of such a tool for nanoHUB.org …


Thermophotovoltaic Devices: Combustion Chamber Optimization And Modelling To Maximize Fuel Efficiency, Arnold Chris Toppo, Ernesto Marinero, Zhaxylyk Kudyshev Aug 2018

Thermophotovoltaic Devices: Combustion Chamber Optimization And Modelling To Maximize Fuel Efficiency, Arnold Chris Toppo, Ernesto Marinero, Zhaxylyk Kudyshev

The Summer Undergraduate Research Fellowship (SURF) Symposium

Currently, 110 billion cubic meters of natural gas (primarily methane), a potent greenhouse gas, are flared off for environmental and safety reasons. This process results in enough fuel to provide the combined natural gas consumption of Germany and France. The research team developed a thermophotovoltaic device to convert thermal energy to electricity at a high efficiency using proprietary emitters and combustion system. With the current focus being fuel efficiency and the combustion process, the assembly was simulated using ANSYS Fluent modelling software and the following parameters were optimized: air/fuel ratios, flow rates, and inlet sizes. Simultaneously the heat transfer across …


Grain Boundary Motion Analysis, Jeremy Marquardt, Xiaorong Cai, Marisol Koslowski Aug 2018

Grain Boundary Motion Analysis, Jeremy Marquardt, Xiaorong Cai, Marisol Koslowski

The Summer Undergraduate Research Fellowship (SURF) Symposium

Grain growth is a mechanism to relax residual stresses in thin films. These grains grow out of the thin film surface and are known as whiskers. These whiskers can cause short circuits, so developing scalable and cost effective solutions would increase the reliability and utility of tin electronics. A popular of method of examining tin whiskering is microscopic simulation, as it provides an accurate and cost effective way to predict the consequences of proposed models. Specifically examining the evolution of grain boundaries, this paper aims to present the results of grain boundary motion simulations through a generalized program that streamlines …


Modelling Catalytic Structures With Python And Ase, Tommie L. Day, Peilin Liao, Pilsun Yoo Aug 2017

Modelling Catalytic Structures With Python And Ase, Tommie L. Day, Peilin Liao, Pilsun Yoo

The Summer Undergraduate Research Fellowship (SURF) Symposium

Voltaic cells hold great potential as a source of clean electricity generation. These fuel sources are more efficient than combustion engines, and they do not produce environmentally harmful by-products. The electrochemical reaction which occurs within the cell is typically catalyzed by platinum, which increases the cost. The search for a better performing, less expensive catalyst is hindered by the lack of a complete, predictive theory of catalysis. Using Quantum Espresso and the Atomic Simulation Environment library for Python, we created a tool for nanoHUB.org which can visually and computationally model catalytic surfaces. This tool can simulate nanoparticles and metallic surfaces …


Simulating Dynamic Failure Of Polymer-Bonded Explosives Under Periodic Excitation, Rachel Kohler, Camilo Duarte Cordon, Marisol Koslowski Aug 2017

Simulating Dynamic Failure Of Polymer-Bonded Explosives Under Periodic Excitation, Rachel Kohler, Camilo Duarte Cordon, Marisol Koslowski

The Summer Undergraduate Research Fellowship (SURF) Symposium

Accidental mishandling of explosive materials leads to thousands of injuries in the US every year. Understanding the mechanisms behind the detonation process is crucial to prevent such accidents. In polymer-bonded explosives (PBX), high-frequency mechanical excitation generates thermal energy and can lead to an increase in temperature and vapor pressure, and potentially the initiation of the detonation process. However, the mechanisms behind this energy release, such as the effects of dynamic fracture and friction, are not well understood. Experimental data is difficult to collect due to the different time scales of reactions and vibrations, so research is aided by running simulations …


Modelling The Softening Behaviour During Galvanizing Of Various Steel Grades, Kevin Banks, Rorisang Maubane, Thabang Makwena Oct 2016

Modelling The Softening Behaviour During Galvanizing Of Various Steel Grades, Kevin Banks, Rorisang Maubane, Thabang Makwena

The 8th International Conference on Physical and Numerical Simulation of Materials Processing

No abstract provided.


Thermodynamic Simulation For Solidification Path In Die Casting Alloy Development, Mohamad Rusydi Mohamad Yasin, Dongke Sun, Qingyou Han Oct 2016

Thermodynamic Simulation For Solidification Path In Die Casting Alloy Development, Mohamad Rusydi Mohamad Yasin, Dongke Sun, Qingyou Han

The 8th International Conference on Physical and Numerical Simulation of Materials Processing

No abstract provided.


Simulation For Carbon Nanotube Dispersion And Microstructure Formation In Cnts/Mg Composite Fabricated With Ultrasonic Processing, Yuansheng Yang, Fuze Zhao, Shaozhen Zhu, Xiaohui Feng Oct 2016

Simulation For Carbon Nanotube Dispersion And Microstructure Formation In Cnts/Mg Composite Fabricated With Ultrasonic Processing, Yuansheng Yang, Fuze Zhao, Shaozhen Zhu, Xiaohui Feng

The 8th International Conference on Physical and Numerical Simulation of Materials Processing

No abstract provided.


Modelling The Softening Behaviour During Galvanizing Of Various Steel Grades, Kevin Banks, Rorisang Maubane, Thabang Makwena Oct 2016

Modelling The Softening Behaviour During Galvanizing Of Various Steel Grades, Kevin Banks, Rorisang Maubane, Thabang Makwena

The 8th International Conference on Physical and Numerical Simulation of Materials Processing

No abstract provided.


Temperature Distributions Influencing Lateral Spread In Industrial Hot Rolling, Baohui Tian, Siegfried Kleber, Silvia Zinner, Peter Markiewicz Oct 2016

Temperature Distributions Influencing Lateral Spread In Industrial Hot Rolling, Baohui Tian, Siegfried Kleber, Silvia Zinner, Peter Markiewicz

The 8th International Conference on Physical and Numerical Simulation of Materials Processing

No abstract provided.


Study On Growth Model Of Cellular Automata Method In Solidification Simulation, Zhao Guo, Jian-Xin Zhou, Ya-Jun Yin, Chang-Chang Liu Oct 2016

Study On Growth Model Of Cellular Automata Method In Solidification Simulation, Zhao Guo, Jian-Xin Zhou, Ya-Jun Yin, Chang-Chang Liu

The 8th International Conference on Physical and Numerical Simulation of Materials Processing

No abstract provided.


Metamodels Of Residual Stress Buildup For Machining Process Modeling, Stuart B. Mccrorie, Michael Sangid Aug 2016

Metamodels Of Residual Stress Buildup For Machining Process Modeling, Stuart B. Mccrorie, Michael Sangid

The Summer Undergraduate Research Fellowship (SURF) Symposium

In the process of machining materials, stresses, called residual stresses, accumulate in the workpiece being machined that remain after the process is completed. These residual stresses can affect the properties of the material or cause part distortion, and it is important that they be calculated to prevent complications from arising due to the residual stresses. However, these calculations can be incredibly computationally intensive, and thus other methods are needed to predict the residual stresses in materials for quick decision-making during machining. By using metamodels - a method of representing data where few data points exist - we can achieve an …


Thermal And Mechanical Properties Of Polymers Using Molecular Dynamics, Daniel Glass, Alejandro Strachan, Lorena Alzate-Vargas, Chunyu Li, Benjamin Haley Aug 2015

Thermal And Mechanical Properties Of Polymers Using Molecular Dynamics, Daniel Glass, Alejandro Strachan, Lorena Alzate-Vargas, Chunyu Li, Benjamin Haley

The Summer Undergraduate Research Fellowship (SURF) Symposium

Polymer systems have gained attention during the past years because of their technological and industrial applications. Simulations, particularly molecular dynamics, are very useful for exploring properties of amorphous polymers, without using experiments. Our goal is to create a readily-available tool that will perform MD simulations in order to get thermal and mechanical properties (Glass transition temperature, Young Modulus) of the polymers. The work that has been done will be part of a tool to help people to learn about polymer properties including Glass Transition Temperature. We model some polymers at a scale of 10,000 atoms. The tool uses LAMMPS to …


Micro-Mechanics Simulation Tool Optimization, Ruixuan Ren, Marisol Koslowski Aug 2014

Micro-Mechanics Simulation Tool Optimization, Ruixuan Ren, Marisol Koslowski

The Summer Undergraduate Research Fellowship (SURF) Symposium

Crystalline films grown epitaxially on substrates consisting of a different crystalline material are of considerable interest in optoelectronic devices and the semiconductor industry. One way to progress in this field is to develop simulation tools based on specially designed numerical method. A nanoHUB simulation tool was developed based on the phase field theory, which considers the propagation of dislocations inside the crystalline film. However, the current tool needs several improvements to be more realistic and user-friendly. First, the inputs of the simulation tool are adjusted so that the user can use this tool directly without any additional calculation. The output …


Simulation Of Bio-Inspired Porous Battery Electrodes, Raju Gupta, R. Edwin Garcia, Rui Tu Aug 2014

Simulation Of Bio-Inspired Porous Battery Electrodes, Raju Gupta, R. Edwin Garcia, Rui Tu

The Summer Undergraduate Research Fellowship (SURF) Symposium

Advancement of technology has led to the increase in use of electronic devices. However, longer life of the rechargeable battery used in electronic devices is one of the biggest issue and demand in the world of electronic devices at present. Battery's performance is affected by the orientation, arrangement, shape and size, and porosity of the materials out of which battery electrodes are made. The goal of this project is to develop a set of numerical libraries that allow developing material micro structures that will allow increasing the performance of rechargeable batteries. We focused on the development of an algorithm that …


Microstructure Development Of Granular System During Compaction, Chen Shang, Marcial Gonzalez Aug 2014

Microstructure Development Of Granular System During Compaction, Chen Shang, Marcial Gonzalez

The Summer Undergraduate Research Fellowship (SURF) Symposium

Granular materials is the second most manipulated material in the industry today. They are easy to transport and more and more newly developed materials cannot stand the process of traditional casting, like energetic materials and bio-materials, but will survive the powder compaction process. Having a better understanding of the microstructure development of granular systems during compaction process, especially for particles that will heavily deform under loading, will give an insight of how to better process the powders to produce materials with overall better performance comparing to bulk materials. The main theory and mechanism applied are Hertz law and nonlocal contact …


Crack Propagation Simulation Tool, Nilofer Rajpurkar, Hojin Kim, Alejandro Strachan Aug 2014

Crack Propagation Simulation Tool, Nilofer Rajpurkar, Hojin Kim, Alejandro Strachan

The Summer Undergraduate Research Fellowship (SURF) Symposium

In the massively engineered world that exists today, understanding material behavior is of paramount importance in caring for human safety in design. Molecular dynamic simulations on crack propagation through materials allow visualization of material behavior under stress. The tool, developed by the nanoHUB group as a part of the Network for Computational Nanotechnology at Purdue University, makes performing such simulations accessible to undergraduate students, highly qualified researchers, and all those in between. First, the input deck for the simulation parameters was simplified from the complex, language-specific code into a simple, user-friendly Graphic User Interface (GUI). Several interesting example cases were …


Next Generation Crystal Viewing Tool, Zach Schaffter, Gerhard Klimeck Oct 2013

Next Generation Crystal Viewing Tool, Zach Schaffter, Gerhard Klimeck

The Summer Undergraduate Research Fellowship (SURF) Symposium

The science and engineering community is limited when it comes to crystal viewing software tools. Each tool lacks in a different area such as customization of structures or visual output. Crystal Viewer 2.0 was created to have all of these features in one program. This one tool simulates virtually any crystal structure with any possible material. The vtkvis widget offers users advanced visual options not seen in any other crystal viewing software. In addition, the powerful engine behind Crystal Viewer 2.0, nanoelectronic modeling 5 or (NEMO5), performs intensive atomic calculations depending on user input. A graphical user interface, or GUI, …


Nanohub - Crystal Viewer 2.0, Kevin Margatan, Gerhard Klimeck Oct 2013

Nanohub - Crystal Viewer 2.0, Kevin Margatan, Gerhard Klimeck

The Summer Undergraduate Research Fellowship (SURF) Symposium

nanoHUB is an online compilation of tools for simulations. Equipped with 3-D simulations and a capability to solve very complex calculations, nanoHUB provides its users worldwide with various tools to help them finish their assignments. One of the tools available is called a Crystal Viewer Tool, an advanced crystal visualization tool. This tool allows users to generate various crystal types including their every single detail. Currently, a newer version, called Crystal Viewer 2.0, is being tested prior to its release. However, this tool is lacking some important features and a GUI that is not as user friendly as expected. The …


Python-Based Simulation Tool For Kinetic Monte Carlo, Zaiwei Zhang, R. Edwin García Oct 2013

Python-Based Simulation Tool For Kinetic Monte Carlo, Zaiwei Zhang, R. Edwin García

The Summer Undergraduate Research Fellowship (SURF) Symposium

Simulation tools are highly needed for testing or designing nanotechnology in university research projects.The problem in the current simulation tool used in our research, which is conducted by Prof.Garcia in MSE department at Purdue, is that users cannot observe the changing numbers of diffusivities during Vacancy Diffusion simulations between different materials. Also, there is no Graphic User Interface for the simulation tools.To solve the problem, the Virtual Kinetics of Materials Laboratory program is used to create the Graphic User Interface. Also, GTK+ toolkit has been used to create a pop-up window displaying updated diffusivities during the simulation. For user purpose, …