Gaurav S. Deshmukh

Graduate Research Assistant

Advised by Professor Jeffrey Greeley



Professional Networks



Background

Education

Institute of Chemical Technology, Mumbai, B.E. Chemical Engineering (2015 - 2019)
Purdue University, Ph.D. Chemical Engineering (2019 – Present)

Experience

  • Bharat Petroleum Corporation Limited, Summer Intern (2018)
  • Institute of Chemical Technology (Mumbai), Literary Club Secretary (2017-2018)
  • Dasgupta group, Indian Institute of Technology Bombay, Summer Research Intern (2017)

Project Description

My project involves the study and design of suitable electro-catalysts through the application of high-throughput data science techniques as well as first-principles Density Functional Theory calculations.

Recent Publications

  • Dean, David P., Gaurav S. Deshmukh , Christopher K. Russell, Kuixin Zhu, Christina W. Li, Jeffrey P. Greeley, Denis Leshchev, Eli Stavitski, and Jeffrey T. Miller. "Valence-to-core X-ray emission spectroscopy to resolve the size-dependent valence electronic structure of Pt nanoparticles." Catalysis Science & Technology 14, no. 9 (2024): 2580-2592.

  • Deshmukh, Gaurav, Noah J. Wichrowski, Nikolaos Evangelou, Pushkar G. Ghanekar, Siddharth Deshpande, Ioannis G. Kevrekidis, and Jeffrey Greeley. "Active learning of ternary alloy structures and energies." npj Computational Materials 10, no. 1 (2024): 116.

  • Deshmukh, Gaurav, Pushkar Ghanekar, and Jeffrey Greeley. "A combined first-principles and data-driven computational framework to analyze the surface structure, composition, and stability of binary alloy catalysts." The Journal of Physical Chemistry C (2024).