Bio

Education

  • Ph.D in Materials Science and Engineering, University of Michigan, USA, 2022
    Certificate in Computational Discovery and Engineering
    Thesis title: Modelling the structural and chemical stability of materials in reactive environments using multiscale methods
    Advisor: Liang Qi

  • M.S. in Materials Science and Engineering, Cornell University, USA, 2017
    Thesis title: The Structure and Chemistry of Epitaxial 2D Chalcogenides
    Advisor: Huili Grace Xing

  • B.Tech in Metallurgical and Materials Engineering, IIT Madras, India, 2015
    Minor in Management Studies
    Thesis title: Printed Silver Lines in MIS Solar Cells
    Advisor: Parasuraman Swaminathan

Skills

  • Methods : Bayesian optimization, force-field development, active learning, electronic structure
  • Atomic simulation : VASP, Quantum ESPRESSO, LAMMPS, ART
  • Materials simulation : Thermo-Calc, Abaqus FEA
  • Computation : Python (Numpy, mpi4py, asyncio), web crawling (selenium, beautifulSoup)
  • Machine Learning Analysis : Python (Pytorch, Scikit, OpenCV, Pandas, TensorFlow), DeePMD, Mathematica, R
  • Materials Informatics : Pymatgen, ASE, RDKit, Chemprop, matminer
  • Visualization : Python (Dash, plotly, seaborn), LaTeX
  • Systems : Windows, Linux, Github, HPC