Inverse design of nanoporous crystalline reticular materials with deep generative models Z Yao, B Sánchez-Lengeling, NS Bobbitt, BJ Bucior, SGH Kumar, ... Nature Machine Intelligence 3 (1), 76-86, 2021 | 350 | 2021 |
Prediction of MOF Performance in Vacuum Swing Adsorption Systems for Postcombustion CO2 Capture Based on Integrated Molecular Simulations, Process … TD Burns, KN Pai, SG Subraveti, SP Collins, M Krykunov, A Rajendran, ... Environmental science & technology 54 (7), 4536-4544, 2020 | 179 | 2020 |
Imparting gas selective and pressure dependent porosity into a non-porous solid via coordination flexibility S Nandi, P De Luna, R Maity, D Chakraborty, T Daff, T Burns, TK Woo, ... Materials Horizons 6 (9), 1883-1891, 2019 | 24 | 2019 |
Intercalation of Coordinatively Unsaturated FeIII Ion within Interpenetrated Metal–Organic Framework MOF‐5 RJ Holmberg, T Burns, SM Greer, L Kobera, SA Stoian, I Korobkov, S Hill, ... Chemistry–A European Journal 22 (23), 7711-7715, 2016 | 15 | 2016 |
The one-electron reduction of dithiolate and diselenolate ligands EAC Bushnell, TD Burns, RJ Boyd Physical Chemistry Chemical Physics 16 (22), 10897-10902, 2014 | 12 | 2014 |
The one-electron oxidation of a dithiolate molecule: The importance of chemical intuition EAC Bushnell, TD Burns, RJ Boyd The Journal of Chemical Physics 140 (18), 2014 | 11 | 2014 |
Inverse design of nanoporous crystalline reticular materials with deep generative models. Nat. Mach. Intell. 3, 76–86 Z Yao, B Sánchez-Lengeling, NS Bobbitt, BJ Bucior, SGH Kumar, ... | 9 | 2021 |
Inverse design of nanoporous crystalline reticular materials with deep generative models, 2020 Z Yao, B Sanchez-Lengeling, NS Bobbitt, BJ Bucior, SGH Kumar, ... DOI: https://doi. org/10.1038/s42256-020-00271-1, 76-86, 0 | 6 | |
A unified approach to SimpleTreat input and settings for wastewater treatment removal predictions TD Burns, M Beking, J Shen, J De Knecht, J Bakker, P van Vlaardingen, ... Integrated Environmental Assessment and Management, vjae049, 2025 | | 2025 |
Pores to Process: The In Silico Study of Metal-Organic Frameworks from Crystal Structure to Industrial Pressure Swing Adsorption for Postcombustion Carbon Capture and Storage TD Burns Université d'Ottawa/University of Ottawa, 2022 | | 2022 |
Imparting gas selective and pressure dependent porosity into a non-porous solid via coordination flexibility R VAIDHYANATHAN, T Daff, PD Luna, D CHAKRABORTY, T Burns, ... Royal Society of Chemistry, 2019 | | 2019 |