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Computational Materials Science Lab

Texas A&M University College of Engineering

Alumni

Anas Abu-Odeh

n/a

Currently an undergraduate Mechanical Engineering senior at Texas A&M. I am working on using a continuous constraint satisfaction algorithm (provided by Dr. Richard Malak’s group) to search high-entropy alloy space and feasible liquid metal dealloying systems. Previously, I collected data points of different austenitic steel compositions and their stacking fault energy (SFE) as well as collecting data points for the SFE of magnesium alloys.

 

ANAS graduated and started his graduate studies @ Berkeley. Congratulation Anas… [Summer 2017]

 

 

Amir Behbahanian

amirbehbahanian@tamu.edu

n/a

Post-doctoral researcher
Arroyave Research Group, Texas A&M U.

Office: Doherty Bldg., A301
Phone:
E-Mail: Amirbehbahanian@tamu.edu

Amir is currently working as a Software Engineer specializing in machine learning model development, leveraged his extensive expertise in both machine learning and material science. During his tenure as a Postdoctoral Researcher at Texas A&M University spearheading a team of Ph.D. students, Amir applied his interdisciplinary knowledge to develop cutting-edge machine learning models, including the utilization of CatBoost to predict material properties. Furthermore, he delved into the realm of Neural Network development, specifically focusing on interatomic potentials, showcasing his versatility in tackling complex challenges at the intersection of materials science and artificial intelligence.

Richard Couperthwaite

richardcouperthwaite@tamu.edu

n/a

I started as a Ph.D. Student with Dr. Arroyave’s Group in Fall 2017, and have been working on the computational design of steel materials using thermodynamics and information-fusion techniques. Side projects have extended into the use of machine learning techniques for quantification of microstructures.

Before Starting my Ph.D. I worked in materials research and development at Mintek in South Africa. Some of my focus areas while working there was the development of more corrosion and oxidation resistant FeAl alloys, colored gold and platinum jewelry alloys and metal spray forming.

Thien Duong

terryduong84@tamu.edu

n/a

About me:

I’m currently a PhD candidate in Mechanical Engineering at Texas A&M University. I acquired my BS degree in Mechatronics at the University of Technology – Ho Chi Minh City, Vietnam in 2007. Later, I was pursuing M.S. in Control and System at Texas A&M University, a university of traditions and honors to me, starting in Fall 2008. During my MS career, I realized my passion for Materials Science, particularly Computational Materials Science and Engineering; I decided to change my major for PhD career at the same beloved school in Spring 2011. I find that this decision is a great turn in my life, in which I’m passionately enjoying my work, researches, studies and above all my life as a materials scientist.

Research:
Methodology: At the moment, I’m specializing in Ab initio study of electronic structures in materials. In specific, the first principle method I’m working on is Density Functional Theory (DFT) – A method to solve the Schodinger’s equation for electronic structures and properties that can be derived from it. I’m mostly interested in using DFT to study the thermodynamic properties of materials. From these calculated quantities, it can be explained why materials exist in a particular form. By combining with CALPHAD – A package to calculate phase diagrams, one can further understand more about the microstructure evolution of materials and their stable structure at a specific temperature and composition.
Materials of Interest: The materials I’m working on include: metallic fuels for Gen-IV reactors, MAX phases – high temperature advance alloys, high entropy alloys, shape memory alloys and thin film diffusion.
Achievements:
Summer 2012 – Intern at Lawrence Livermore National Laboratory.
Spring 2012 – Lab Assistant at IIMEC Winter School – Texas A&M University.
Summer 2011 – Scholarship Fellow at ICMEd Summer School – University of Michigan.

Supriyo Ghosh

Supriyo.ghosh@tamu.edu

n/a

Sean Gibbons

About me:  I am currently a PhD student in Materials Science and Engineering Program in the Mechanical Engineering Department here at Texas A&M University.
 

Interests: The application of computational methods to evaluate complex data sets for simulation initialization and to develop holistic materials science and engineering focused models; use atomistic scale information to tailor continuum level phase-field-models to timely and accurately simulate microstructural evolution for a given system, that can in-turn be used to drive experimental research and process and design cycles.

Education:
2009 • MS in Applied Mathematics
           Naval Postgraduate School, (Monterey, CA)
           Title of Thesis: Impacts of Sigma Coordinates on the Euler and Navier-Stokes Equations using Continuous
            Galerkin Methods
           Advisor: Francis X. Giraldo
2009 • MS in Numerical Weather Prediction
           Naval Postgraduate School, (Monterey, CA)
           Title of Thesis: Impacts of Sigma Coordinates on the Euler and Navier-Stokes Equations using Continuous                           Galerkin Methods
           Advisor: Tony Eckel
2003 • BS in Materials Sciences
           United States Air Force Academy, (Colorado Springs, CO)
1999 • USAF Academy Preparatory School
           United States Air Force Academy, (Colorado Springs, CO)
Current Research Areas:
Multi-scale Modeling:
    – Evolution of U-Zr Metallic Nuclear Fuels
Phase Field Modeling
    – Transient Liquid Phase Lead Free Soldering
    – Microelasticity
First Principle Calculations:
    – Ni-Ti-X based Shape Memory Alloys
Parallel Algorithm Design:
    – Mesh Adaptive Direct Search (MADS) Algorithms
    – Genetic Algorithms

Pejman Honarmandi

hona107@tamu.edu

n/a

Post-doctoral researcher
Arroyave Research Group, Texas A&M U.

Office: Doherty Bldg., A301
Phone:
E-Mail: hona107@tamu.edu

 

I am from Iran and currently a post-doctoral researcher of Materials Science & Engineering at Texas A&M University. I received a bachelor’s degree from Sharif University of Technology (SUT), and subsequently a master’s degree from Khaje Nasir Toosi University of Technology (KNTU). I am proud to declare that I was recognized as a top graduate student among the graduates of academic year of 2008-2009, and honored for obtaining the highest total GPA.

Because of my intense enthusiasm for investigating in different fields of materials science, I did various experimental and theoretical research during my past education, including “assessment of surface resistance in polymeric nano-composite materials”, “evaluation of hot deformation behavior in steels and titanium alloys, “synthesis, characterization, and microscopic analysis of different types of nano-materials”, etc, which led to the publication of different ISI and conference papers.

I joined Prof. Arroyave’s group in Fall 2014, and my research field of interest is alloy design under uncertainty, including modeling and Bayesian uncertainty analysis of plastic flow behavior of low-alloy TRIP-assisted steels, and precipitation kinetics of NiTi based shape memory alloys.

Xueqin Huang

Xueq13@tamu.edu

n/a

Jaylen James

jaylen_james@tamu.edu

n/a

Graduate Research Assistant
Arroyave Research Group, Texas A&M U.

Office: Doherty Bldg., A301
Phone:
E-Mail: jaylen_james@tamu.edu

 

Jaylen James graduated from Priarie View A&M University with a Bachelors degree in Mechanical Engineering. He is now pursuing his PhD. Currently, his research focus is in fusing information from multi-fidelity sources using model reification. This project is in collaboration with the Air Force Research Laboratory. The methods Jaylen is working on will help researchers better predict material properties and help enhance the material design process for various applications.

Tanner Kirk

tannerkirk@tamu.edu

n/a

Graduate Research Assistant
Design Systems Laboratory, Texas A&M

Office: Doherty Bldg., 309
Email: tannerkirk@tamu.edu

Tanner Kirk is a Ph.D. student in the Mechanical Engineering Department at Texas A&M University. He is co-advised by Dr. Richard Malak and Dr. Raymundo Arroyave. Tanner researches the use of robotic path planning algorithms to design Functionally Graded Materials (FGMs).  The methods Tanner develops use thermodynamic predictions of phase formation (CALPHAD) to plan FGMs that avoid the deleterious phases that often plague the manufacturing of FGMs. These methods are scalable to FGMs composed of an arbitrary number of elements and can be used to optimize FGMs for performance. Tanner’s other research interests are machine learning, optimization, and materials design.

D3EM ePortfolio

Selected Publication: Kirk, T., Galvan, E., Malak, R., & Arroyave, R. (2018). Computational Design of Gradient Paths in Additively Manufactured Functionally Graded Materials. Journal of Mechanical Design, 140(11), 111410.

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