Chenghao Liu
I am a student of chemistry and computer science. I am in the third year of my Ph.D. study at McGill University (2019-present) supervised by Prof. Dmitrii (Dima) Perepichka, and I am concurrently undergoing an internship at Mila with Prof. Yoshua Bengio. I am a Vanier scholar (2021-present). I obtained my BSc (Hons) from McGill University (2016-2019) working with Prof. Perepichka, and earlier with Prof. Reinhard Hesse in geology. I have also been supervised by Dr. Jean-Michel Sellier at Mila. Before undergraduate studies, I spent my younger years in Germany, the Netherlands, and China.


My current focus is on organic materials with strong electronic interactions: how does uncharted physical properties emerge from molecular and supramolecular structures, and their design from the infinite chemical space. In particular, I am interested in:

Feel free to email me at chenghao.liu@mail.mcgill.ca. My Google Scholar is here.


Publications

2022

HOF Band Structure

2D PTM Polymer

RetroGNN JCIM

GFlowNet Evaluation

Heterostructure

2021

Glaser Coupling

MOF homojunction

2020

RetroGNN

radical luminescence

2D to 3D COF

Triangulene COF

Photovoltaics substituent

2019

Hydrogen bond

sp2 COF