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Computational Materials Science Lab

Texas A&M University College of Engineering
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  • On the interfacial phase growth and vacancy evolution during accelerated electromigration in Cu/Sn/Cu microjoints
    On the interfacial phase growth and vacancy evolution during accelerated electromigration in Cu/Sn/Cu microjoints
  • Phase Field Modeling of Joint Formation During Isothermal Solidification in 3DIC Micro Packaging
    Phase Field Modeling of Joint Formation During Isothermal Solidification in 3DIC Micro Packaging
  • Thermodynamics of Thermoelectric Materials Under Non-equilibrium Synthesis Conditions
    Thermodynamics of Thermoelectric Materials Under Non-equilibrium Synthesis Conditions (Click on the image for the article).
  • Uncertainty quantification and propagation in CALPHAD modeling
    Uncertainty quantification and propagation in CALPHAD modeling
  • Autonomous efficient experiment design for materials discovery with Bayesian model averaging
    Autonomous efficient experiment design for materials discovery with Bayesian model averaging
  • On the interfacial phase growth and vacancy evolution during accelerated electromigration in Cu/Sn/Cu microjoints
  • Phase Field Modeling of Joint Formation During Isothermal Solidification in 3DIC Micro Packaging
  • Thermodynamics of Thermoelectric Materials Under Non-equilibrium Synthesis Conditions
  • Uncertainty quantification and propagation in CALPHAD modeling
  • Autonomous efficient experiment design for materials discovery with Bayesian model averaging

 

  • Dr. Raymundo Arróyave is a Professor in the Department of Materials Science as well as the Department of Mechanical Engineering at Texas A&M University.
  • Dr. Arróyave is a Co-PI of the NSF-Funded International Institute for Multifunctional Materials for Energy Conversion (IIMEC).
  • Dr. Arróyave is the lead-organizer of the 2012 IIMEC Winter School on Computational Materials Science.
  • Dr. Arróyave is the lead-organizer of the 2018 CALPHAD XLVII conference.

Group Barbecue

Our group uses computational materials science tools to investigate material properties at different scales of length and time. We use a variety of tools (such as: Ab Initio calculations, molecular dynamics, Monte Carlo, phase-field models, CALPHAD) to investigate the fundamental properties of complex materials.

group_poster

Group Poster

In the past three years, our research has focused on:

  • Investigation of Microstructural Evolution at Liquid/Solid Interfaces during Lead-free Soldering
  • Computational Materials Design of Novel High-Temperature Shape Memory Alloys
  • Phase Stability in Al-Si-Sr Alloys
  • Thermodynamics and Kinetics of Hydrogen Storage in Mg-based Nano-layered Thin Films
  • Phase Stability in Nuclear Fuel Materials
  • Computational Design of Novel High Strength Steels

Latest News

  • Congratulations to Vahid! October 3, 2019
  • CALPHAD XLVII Conference — Successfully Finished! November 5, 2018
  • Group BBQ with Halloween Theme October 31, 2017
  • CALPHAD XLVII Conference — First Announcement! October 10, 2017
  • Dr. Arroyave becomes full professor October 9, 2017

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