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Jake Burner
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A scalable metal-organic framework as a durable physisorbent for carbon dioxide capture
JB Lin, TTT Nguyen, R Vaidhyanathan, J Burner, JM Taylor, H Durekova, ...
Science 374 (6574), 1464-1469, 2021
5452021
High-Performing Deep Learning Regression Models for Predicting Low-Pressure CO2 Adsorption Properties of Metal–Organic Frameworks
J Burner, L Schwiedrzik, M Krykunov, J Luo, PG Boyd, TK Woo
The Journal of Physical Chemistry C 124 (51), 27996-28005, 2020
722020
ARC–MOF: a diverse database of metal-organic frameworks with DFT-derived partial atomic charges and descriptors for machine learning
J Burner, J Luo, A White, A Mirmiran, O Kwon, PG Boyd, S Maley, ...
Chemistry of Materials 35 (3), 900-916, 2023
702023
The HEALED SBU library of chemically realistic building blocks for construction of hypothetical metal–organic frameworks
M Gibaldi, O Kwon, A White, J Burner, TK Woo
ACS Applied Materials & Interfaces 14 (38), 43372-43386, 2022
142022
What will photo-processing of large, ionized amino-substituted polycyclic aromatic hydrocarbons produce in the interstellar medium?
J Burner, BJ West, PM Mayer
The Journal of Physical Chemistry A 123 (24), 5027-5034, 2019
72019
Structure affecting dissociation energy in polycyclic aromatic hydrocarbon ions
M Diedhiou, J Burner, BJ West, PM Mayer
Chemical Physics Letters 726, 93-98, 2019
62019
Trifluoroacetic acid and trifluoroacetic anhydride radical cations dissociate near the ionization limit
L Lesniak, J Salas, J Burner, M Diedhiou, MA Burgos Paci, A Bodi, ...
The Journal of Physical Chemistry A 123 (29), 6313-6318, 2019
52019
What do we expect from the dissociation of ionized nitro-substituted polycyclic aromatic hydrocarbons in the interstellar medium?
J Burner, B West, PM Mayer
International Journal of Mass Spectrometry 434, 81-86, 2018
42018
MEPO-ML: a robust graph attention network model for rapid generation of partial atomic charges in metal-organic frameworks
J Luo, OB Said, P Xie, M Gibaldi, J Burner, C Pereira, TK Woo
npj Computational Materials 10 (1), 224, 2024
22024
Alarming structural error rates in MOF databases used in data driven workflows identified via a novel metal oxidation state-based method
A White, M Gibaldi, J Burner, RA Mayo, T Woo
12024
MOSAEC-DB: a comprehensive database of experimental metal–organic frameworks with verified chemical accuracy suitable for molecular simulations
M Gibaldi, A Kapeliukha, A White, J Luo, RA Mayo, J Burner, TK Woo
Chemical Science, 2025
2025
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