Publications

Graduate

2025

  1. QuEmb: A Toolbox for Bootstrap Embedding Calculations of Molecular and Periodic Systems
    Cho, Minsik; Meitei, Oinam Romesh; Weisburn, Leah P.; Weser, Oskar; Weatherly, Shaun; Alexiu, Alexandra; Hanscam, Rebecca; Tran, Henry K.; Ye, Hong-Zhou; Welborn, Matthew; Ricke, Nathan; Tsuchimochi, Takashi; Trofimov, Aleksandr; Orkhon, Temujin; Whelpley, Noah; Luo, Carina;  and Van Voorhis, Troy
    Journal of Physical Chemistry A 2025
    Website
  2. How to Use Quantum Computers for Biomolecular Free Energies
    Günther, Jakob; Weymuth, Thomas; Bensberg, Moritz; Witteveen, Freek; Teynor, Matthew S.; Thomasen, F. Emil; Sora, Valentina; Bro-Jørgensen, William; Husistein, Raphael T.; Erakovic, Mihael; Miller, Marek; Weisburn, Leah;  Cho, Minsik; Eckhoff, Marco; Harrow, Aram W.; Krogh, Anders; Van Voorhis, Troy; Lindorff-Larsen, Kresten; Solomon, Gemma; Reiher, Markus;  and Christandl, Matthias
    2025
    Website (OpenAccess)
  3. Multiscale Embedding for Quantum Computing
    Weisburn, L. P.;  Cho, Minsik; Bensberg, Moritz; Meitei, Oinam R.; Reiher, Markus;  and Van Voorhis, Troy
    Journal of Chemical Theory and Computation 2025
    Website
  4. High Ground State Overlap via Quantum Embedding Methods
    Erakovic, Mihael; Witteveen, Freek; Harley, Dylan; Günther, Jakob; Bensberg, Moritz; Meitei, Oinam Romesh;  Cho, Minsik; Van Voorhis, Troy; Reiher, Markus;  and Christandl, Matthias
    PRX Life 2025
    arXiv Website (OpenAccess)

2024

  1. Bootstrap Embedding for Molecules in Extended Basis Sets
    Tran, Henry K.; Weisburn, Leah P.;  Cho, Minsik; Weatherly, Shaun; Ye, Hong-Zhou;  and Van Voorhis, Troy
    Journal of Chemical Theory and Computation 2024
    Website
  2. cclib 2.0: An Updated Architecture for Interoperable Computational Chemistry
    Berquist, Eric; Dumi, Amanda; Upadhyay, Shiv; Abarbanel, Omri D.;  Cho, Minsik; Guar, Sagar; Gil, Victor H. C.; Hutchison, Geoffrey R.; Lee, Oliver S.; Rosen, Andrew S.; Schamnad, Sanjeed; Schneider, Felipe S. S.; Steinmann, Casper; Stolyarchuk, Maxim; Vandezande, Jonathon E.; Zak, Weronika;  and Langner, Karol M.
    The Journal of Chemical Physics 2024
    Website (OpenAccess)

Undergraduate

2022

  1. Periodic Density Matrix Embedding for CO Adsorption on the MgO(001) Surface
    Mitra, Abhishek; Hermes, Matthew R.;  Cho, Minsik; Agarwal, Valay;  and Gagliardi, Laura
    The Journal of Physical Chemistry Letters 2022
    Chemrxiv Website (OpenAccess)

2021

  1. Exploring Avenues beyond Revised DSD Functionals: I. Range Separation, with xDSD as a Special Case
    Santra, Golokesh;  Cho, Minsik;  and Martin, Jan M. L.
    The Journal of Physical Chemistry A 2021
    arXiv Website

2020

  1. The Atomic Partial Charges Arboretum: Trying to See the Forest for the Trees
    Cho, Minsik; Sylvetsky, Nitai; Eshafi, Sarah; Santra, Golokesh; Efremenko, Irena;  and Martin, Jan M. L.
    ChemPhysChem 2020
    Website (OpenAccess)

2018

  1. Ab Initio Finite Temperature Auxiliary Field Quantum Monte Carlo
    Liu, Yuan;  Cho, Minsik;  and Rubenstein, Brenda
    Journal of Chemical Theory and Computation 2018
    arXiv Website

High School

2013

  1. Implementation of Modular Structure in CANSAT System (캔위성을 위한 모듈형 구조 개발)
    Lee, Geunjeong;  Cho, Minsik; Kim, Hyunjae;  and Park, Eunseo
    In Proceedings of the Korean Society for Aeronautical and Space Sciences 2013
    Website