Research Interest:

  • Seismology Geology and Tectonophysics
  • Computational Materials
  • Molecular Dynamics
  • First Principles calculations
  • Materials at extreme conditions
  • Earth and Planetary Science, modeling

I am using the PGM framework developed in my team to investigate ε-Fe at the conditions of the Earth's core, which is also applicable for exoplanetary interiors' conditions.

POSTER DEMO
What I've Researched

Computational Materials & Geoscience: ε-Fe at Exoplanetary Conditions

Research Assistant @ Columbia University, LDEO

Mar. 2018 - Present

  • Performed first-principles calculations in earth inner-core and explanatory conditions on high-performance computers.
  • Proposed a temperature-dependent phonon gas model (TPGM)
  • Developed a novel Python framework for derivations of thermodynamic and thermoelastic properties
  • Investigated computational and experimental thermodynamic properties to confirm the good performance of results
  • Calculated Mass-Radius relation to model the iron-dominant planetary interiors

Study of Variable Cell Molecular Dynamics

Research Assistant @ Columbia University

Jan. 2018 - Mar. 2018

  • Developed a novel Python framework for derivations of thermodynamic and thermoelastic properties.
  • Implemented microcanonical MD simulation using velocity rescaling to equilibrate FCC-Ne at finite temperatures
  • Optimized the structures of FCC, BCC, HCP Ne in varied pressures, calculated corresponding equations of state and bulk modulus for each structure, and the phase diagram below 10 GPa.
Some Things I've Made

ε-Fe Research Repositories

Jun, 2018 - Present

What my ε-Fe team and I wrote.

Python
research
first principles
Github Repo
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How to Reach me