Manuscripts submitted for publication

R. Wang†, B.C. Bukowski†, J. Duan, J. Sui, R.Q. Snurr, J.T. Hupp “Art of Architecture: Efficient Transport through Solvent-filled Metal-Organic Frameworks Regulated by Topology”, submitted. †denotes equal contribution from both authors.

2021

[16] B.C. Bukowski, F.J. Keil, P.I. Ravikovitch, G. Sastre, R.Q. Snurr, M-O. Coppens “Connecting Theory and Simulation with Experiment for the Study of Diffusion in Nanoporous Solids”, Adsorption .

[15] B.C. Bukowski*, W.N. Delgass, J. Greeley “Gold Stability and Diffusion in the Au/TS-1 Catalyst”, J. Phys. Chem. C 125 (8), 4519-4531. * denotes corresponding author

2020

[14] B.C. Bukowski and R.Q. Snurr “Topology-dependent Alkane Diffusion in Zirconium Metal-organic Frameworks”, ACS Applied Materials and Interfaces 12 (50), 56049-56059.

[13] R. Wang, B.C. Bukowski, J. Duan, T.R. Sheridan, A. Atilgan, K. Zhang, R.Q. Snurr, J.T. Hupp, “Investigating the Process and Mechanism of Molecular Transport Within a Representative Solvent-filled Metal-Organic Framework” Langmuir 36 (36) 10853-10859.

[12] J.W. Harris, J.S. Bates, B.C. Bukowski, J. Greeley, R. Gounder, “Opportunities in Catalysis over Metal-Zeotypes Enabled by Descriptions of Active Centers Beyond Their Binding Site”, ACS Catalysis 10 (16) 9476-9495.

[11] J.S. Bates† and B.C. Bukowski†, J. Greeley, R. Gounder, “Structure and Solvation of Confined Water and Water-Alkanol Clusters within Microporous Brønsted Acids and their Effects on Alkanol Dehydration Catalysis”, Chemical Science. 11 (27), 7102-7122 †denotes equal contribution from both authors.

2019

[10] E.C. Wegener, B.C. Bukowski, D. Yang, Z. Wu, A.J. Kropf, W.N. Delgass, J.P. Greeley, G. Zhang, J.T. Miller, Intermetallic Compounds as an Alternative to Single-Atom Alloy Catalysts: Geometric and Electronic Structures from Advanced X-ray Spectroscopies and Computational Studies”, Chem Cat Chem 12 (5) 1325-1333, 2019.

[9] B.C. Bukowski, J.S. Bates, R. Gounder, J. Greeley, “Defect-Mediated Ordering of Condensed Water Structures in Microporous Zeolites”, Angewandte Chemie International Edition 58 (46), 16422-16426, 2019.

[8] J.S. Bates, B.C. Bukowski, J.W. Harris, J.P. Greeley, R. Gounder, “Distinct Catalytic Reactivity of Sn Substituted in Framework Locations and at Defect Grain Boundaries in Sn-Zeolites”, ACS Catalysis 9 (7) 6146-6168, 2019.

[7] D. T. Bregante, A.M. Johnson, A.Y. Patel, E.Z. Ayla, M.J. Cordon, B.C. Bukowski, J. Greeley, R. Gounder, D.W. Flaherty, “Cooperative Effects between Hydrophilic Pores and Solvents: Catalytic Consequences of Hydrogen Bonding on Alkene Epoxidation in Zeolites”, Journal of the American Chemical Society 141 (18), 7302-7319, 2019.

2018

[6] Z. Wu, B.C. Bukowski, Z, Li, C. Milligan, L. Zhou, T. Ma, Y. Wu, Y. Ren, F.H. Ribeiro, W.N. Delgass, J. Greeley, G. Zhang, J. Miller, “Changes in Catalytic and Adsorptive Properties of 2 nm Pt3Mn Nanoparticles by Subsurface Atoms”, Journal of the American Chemical Society 140 (44), 14870-14877, 2018.

[5] B.C. Bukowski, J. Bates, R. Gounder, J. Greeley, “First Principles, Microkinetic, and Experimental Analysis of Lewis Acid Site Speciation During Ethanol Dehydration on Sn-Beta Zeolites”, Journal of Catalysis 365, 261-276, 2018.

2017

[4] V.J. Cybulskis, B.C. Bukowski, H.T. Tseng, J.R. Gallagher, Z. Wu, E. Wegener, A.J. Kropf, B. Ravel, F.H. Ribeiro, J. Greeley, J.T. Miller, “Zinc Promotion of Platinum for Catalytic Light Alkane Dehydrogenation: Insights into Geometric and Electronic Effects”, ACS Catalysis 7 (6) 4173-4181, 2017.

2016

[3] B.C. Bukowski, J. Greeley, “Scaling relationships for molecular adsorption and dissociation in Lewis acid zeolites”, The Journal of Physical Chemistry C 120 (12), 6714-6722, 2016.

2015

[2] B. Bukowski, N.A. Deskins, “The interactions between TiO2 and graphene with surface inhomogeneity determined using density functional theory” Physical Chemistry Chemical Physics 17 (44), 29734-29746, 2015.

[1] Z. Zhu, B. Bukowski, N.A. Deskins, H.S. Zhou, "Bamboo shaped carbon nanotube supported platinum electrocatalyst synthesized by high power ultrasonic-assisted impregnation method for methanol electrooxidation and related density functional theory calculations", International Journal of Hydrogen Energy 40 (5), 2216-2224, 2015.