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Pilsun Yoo

Government of the United States of America - Oak Ridge National Laboratory

1 Bethel Valley Road, P.O. Box 2008, Mail Stop 608

Room B-106, Building 5700

Oak Ridge, TN 37831

United States

  • Government of the United States of America - Oak Ridge National Laboratory

SCHOLARLY PAPERS

3

DOWNLOADS

167

TOTAL CITATIONS

2

Scholarly Papers (3)

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1.

Biochar Data into Structure: A Methodology for Generating Large-Scale Atomistic Representations

Number of pages: 59 Posted: 20 May 2024
Valentina Sierra-Jimenez, Jonathan P. Mathews, Pilsun Yoo, Alice Budai, Farid Chejne, Anthony Dufour and Manuel GarciaPerez
Washington State University, Pennsylvania State University, Government of the United States of America - Oak Ridge National Laboratory, Norwegian Institute of Bioeconomy Research, Universidad Nacional de Colombia, affiliation not provided to SSRN and Washington State University
Downloads 81 (796,622)

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atomistic representations, Biochar, characterization data, Molecular dynamics simulations, structural features

2.

Impact of Oxygen and Methyl Functional Groups on Intermolecular Bridge Formation and Mesophase Pitch Stabilization

Number of pages: 30 Posted: 03 Nov 2025
Pilsun Yoo, Gang Seob Jung, Frederic Vautard, H. M. Meyer, Matthew R. Ryder, Edgar Lara-Curzio and Stephan Irle
Government of the United States of America - Oak Ridge National Laboratory, Government of the United States of America - Oak Ridge National Laboratory, Government of the United States of America - Oak Ridge National Laboratory, Government of the United States of America - Oak Ridge National Laboratory, Government of the United States of America - Oak Ridge National Laboratory, Oak Ridge National Laboratory and Government of the United States of America - Oak Ridge National Laboratory
Downloads 49 (1,086,013)

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mesophase pitch formation, ordered carbon-based solids, aromatic molecular crystals, molecular dynamics, quantum chemistry

3.

Large-Scale Atomistic Model Construction of Subbituminous and Bituminous Coals for Solvent Extraction Simulations with Reactive Molecular Dynamics

Number of pages: 34 Posted: 27 Nov 2023
Pilsun Yoo, Gang Seob Jung, Matthew R. Ryder, Frederic Vautard, Ercan Cakmak, Sungsool Wi, Mattew C. Weisenberger, Edgar Lara-Curzio, Jonathan P. Mathews and Stephan Irle
Government of the United States of America - Oak Ridge National Laboratory, Government of the United States of America - Oak Ridge National Laboratory, Government of the United States of America - Oak Ridge National Laboratory, Government of the United States of America - Oak Ridge National Laboratory, Government of the United States of America - Oak Ridge National Laboratory, Florida State University, University of Kentucky, Oak Ridge National Laboratory, Pennsylvania State University and Government of the United States of America - Oak Ridge National Laboratory
Downloads 37 (1,236,159)
Citation 2

Abstract:

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bottom-up carbonaceous model construction, atomistic coal model, solvent extraction, reactive simulations of coal, ensemble of macromolecules